          147
Energy of minimum      1=     -426.6599038844 first found at step   223937
H       126.4078737957     -163.7593109360     -393.0269610163
H       124.9263788775     -163.0325766107     -393.2953852400
N       125.8521835449     -162.8743672650     -392.8587392036
H       125.8070488114     -162.7945298475     -391.8001865873
C       126.6132475426     -161.7677979772     -393.4369405522
C       125.9798378160     -160.4467140321     -393.0031355430
O       125.1916487429     -160.7153048861     -391.8515855507
H       124.6413092415     -161.4450797737     -392.1564924437
C       128.0684156457     -161.8254545620     -392.9785805867
O       128.3536115074     -162.4503797980     -391.9504285090
N       129.0005105620     -161.2066020651     -393.7083390382
H       128.7259986408     -160.7267407373     -394.5152221524
C       130.4060690419     -161.2028758091     -393.3227161344
C       131.2684987517     -160.7597739693     -394.5152084443
C       132.7743733265     -160.9877160844     -394.3796394519
C       133.7655322201     -160.2993965541     -395.0220453789
C       134.8935530882     -160.8876460799     -394.5500605258
C       133.7831636978     -159.3962429068     -396.0562870390
C       133.3196681770     -161.9556817942     -393.5575394820
N       134.6279160018     -161.8735141000     -393.6874958543
H       135.2764065203     -162.4526316765     -393.2204130219
C       136.1462447454     -160.6306354922     -395.0447599137
C       135.0382603574     -159.1017128956     -396.5698240513
C       136.1942771434     -159.7028492159     -396.0740085190
C       130.6012926343     -160.3165934283     -392.0910574441
O       130.6660862500     -159.0865634990     -392.1525852488
N       130.6805314995     -160.9892373017     -390.9432257946
H       130.8304739077     -161.9600863869     -390.9786487670
C       130.6414752934     -160.3297601577     -389.6490588596
C       129.8985257281     -161.2459630338     -388.6469031859
O       128.6400806993     -161.5374330291     -389.2514370610
H       128.7917581951     -161.7805672702     -390.1789937354
C       129.6656931705     -160.5901142789     -387.2911366890
C       132.0505900329     -159.9656076927     -389.1897900345
O       132.8280686600     -160.7969892988     -388.7100838412
N       132.3937786445     -158.6923408460     -389.3860845702
H       131.7678601925     -158.1143384721     -389.8724396473
C       133.6786719939     -158.1534851881     -388.9643195176
C       133.9434316092     -156.8146697966     -389.6707527849
C       134.4423847305     -156.8994937998     -391.1105883415
C       135.4480400977     -156.1509819629     -391.6603139034
C       135.4922784344     -156.6078459885     -392.9372575950
C       136.0951080492     -155.0038344445     -391.2702699393
C       133.9174195629     -157.7717683080     -392.0448045527
N       134.5835190749     -157.5593455320     -393.1613854406
H       134.4311195556     -158.0221463079     -394.0094696298
C       136.1820092798     -155.9822293026     -393.9438517012
C       136.8208531072     -154.3571656061     -392.2601914972
C       136.8649221983     -154.8358814481     -393.5682608979
C       133.8221018620     -157.9982444346     -387.4503257894
O       133.6193597861     -156.9143933378     -386.8928772532
N       134.1774729745     -159.0725339709     -386.7344462576
H       134.2551541434     -159.9465057818     -387.1861184359
C       134.4412592469     -158.9735772423     -385.3014735156
C       134.2187511937     -160.3157974894     -384.5954349609
C       132.7913041166     -160.8481683319     -384.6645705652
C       132.5574684192     -162.0725371938     -383.7904525538
O       132.1483180291     -161.9053534016     -382.6424957729
O       132.7753573535     -163.1947710443     -384.2530659418
C       135.8490161734     -158.4316151938     -385.0425436879
O       136.7655045417     -159.1321331473     -384.5957757598
N       136.0369432659     -157.1489525077     -385.3715795398
H       135.2692658518     -156.6540845059     -385.7380074092
C       137.3248604765     -156.4774808995     -385.2541627594
C       138.3420397699     -157.0367593772     -386.2405256187
O       138.5027339335     -156.5401717194     -387.3565183155
N       139.0124182117     -158.1069072769     -385.8104890235
H       138.7912870646     -158.4448020511     -384.9153769561
C       139.9723067647     -158.8197011632     -386.6428505657
C       141.2617628859     -159.0637484597     -385.8573988365
C       142.5145550792     -159.3221388629     -386.6939443688
O       143.5706609071     -158.7739349634     -386.3928335069
N       142.5351975289     -160.1272083459     -387.7494635215
H       141.7114359212     -160.5778665221     -388.0406257703
H       143.3973877935     -160.2248312346     -388.2003740264
C       139.3847467063     -160.1557772850     -387.0946723887
O       139.7881836104     -160.7036836520     -388.1245365083
N       138.4216150623     -160.7131089820     -386.3522829734
H       138.0554587017     -160.2189169693     -385.5868862620
C       137.8253079954     -161.9987210832     -386.6809923745
C       137.3332615471     -162.6482503417     -385.3836906722
C       136.7846833527     -164.0604920569     -385.5205065632
C       136.2573426187     -164.5304849467     -384.1738343021
C       135.4325373265     -165.8035189413     -384.3113240464
N       134.1805022841     -165.5464024332     -385.0020642409
H       133.6342631451     -164.7897155667     -384.5186791279
H       134.3341502795     -165.1857281835     -385.9843283990
H       133.6023551360     -166.4046350170     -385.0530532023
C       136.7095334555     -161.7878012964     -387.7068109854
O       135.5104668868     -161.7348395546     -387.4027598668
N       137.1309495809     -161.6248454276     -388.9634203923
H       138.1009649257     -161.6282568334     -389.1272213368
C       136.2151106146     -161.3717056951     -390.0700368709
C       136.9667285063     -160.7428456148     -391.2539494556
C       137.7028789448     -159.4304503804     -390.9784531007
C       138.6858146104     -158.8795489342     -391.7543240604
C       139.0237972058     -157.7632044003     -391.0559803895
C       139.0574188916     -159.0615367208     -393.0642867401
C       137.4765334620     -158.6509763059     -389.8593186533
N       138.3045528345     -157.6307376868     -389.9374198823
H       138.4199554050     -156.9449091732     -389.2374715780
C       139.7638249081     -156.7364044767     -391.5848744558
C       139.8264075997     -158.0507629462     -393.6211559794
C       140.1743784576     -156.9130681050     -392.8969175587
C       135.4759952121     -162.6442331818     -390.4827295740
O       135.7945394444     -163.3219301966     -391.4654614183
N       134.4326106824     -162.9366111665     -389.7078207491
H       134.0843658969     -162.2277906325     -389.1200261697
C       133.7599579521     -164.2257940760     -389.7347164859
C       133.0675033484     -164.4411145633     -388.3686419875
O       134.0854884503     -164.2744165399     -387.3840860305
H       134.4248781745     -163.3640903660     -387.4118492698
C       132.4385917482     -165.8216053599     -388.2178395608
C       132.7775012338     -164.3578762143     -390.8957368283
O       131.7911164688     -163.6202054091     -391.0003888295
N       133.0550650076     -165.3081870306     -391.7931413547
H       133.8968982906     -165.8007881623     -391.7049008113
C       132.1741510374     -165.6109627491     -392.9137925073
C       132.9290292236     -166.3986979180     -393.9907957595
C       133.9657704930     -165.5939671272     -394.7652631167
C       133.7765451771     -164.9215044066     -395.9422603384
C       135.0200212795     -164.4504869786     -396.2135069830
C       132.6644040696     -164.4997308785     -396.6299560842
C       135.2842774205     -165.5148303045     -394.3609354913
N       135.9076975467     -164.7957559270     -395.2745390801
H       136.8559340748     -164.5494438553     -395.2533599143
C       135.2823857438     -163.5301331887     -397.1962303027
C       132.8976873918     -163.5786525771     -397.6409806781
C       134.1784991694     -163.1056861722     -397.9201793813
C       130.8944525973     -166.3399826223     -392.5019589479
O       130.7280710908     -167.5513235244     -392.6805572829
N       129.9631449468     -165.5821708575     -391.9184758998
H       130.1719270588     -164.6381224484     -391.7391480989
C       128.6611217280     -166.1053354294     -391.5368038663
C       128.0579198040     -165.2031388592     -390.4562926013
C       126.7331998159     -165.6593884060     -389.8539163456
C       126.1112272130     -164.6114448981     -388.9279124647
C       125.4285379551     -163.4394924536     -389.6435073821
N       126.3630871772     -162.4623650117     -390.1904420724
H       127.0989232326     -162.8340630513     -390.8536603453
H       126.9659393869     -162.1102139985     -389.3967669567
H       125.9181217272     -161.5779293040     -390.5733657883
C       127.7884092168     -166.1987509983     -392.7888572315
O       126.9667922373     -165.3420659434     -393.1189973583
N       127.9785574742     -167.2674767590     -393.5475053032
H       128.6911847734     -167.8886725523     -393.2709426639
H       127.4220372441     -167.3727195548     -394.3438051486
          147
Energy of minimum      2=     -425.9964070299 first found at step   205065
H        74.1893700565     -132.1471234264     -339.2294210212
H        74.1808270942     -132.5208572433     -340.8589214317
N        73.8439327687     -131.8199024606     -340.1748389466
H        72.7862575647     -131.8087210095     -340.0741267982
C        74.3658919984     -130.4699712647     -340.3818317165
C        73.6953260647     -129.8583747001     -341.6109456889
O        72.4990372688     -130.5886283492     -341.8451667700
H        72.8236296518     -131.4956848696     -341.8640588348
C        74.0970567950     -129.6037808245     -339.1538553355
O        73.1952735231     -129.9269959087     -338.3720088896
N        74.8530761662     -128.5217746390     -338.9488576081
H        75.5559406278     -128.3083388867     -339.5946987473
C        74.6434067086     -127.6400142648     -337.8076582775
C        75.8672127703     -126.7293365777     -337.6217962110
C        75.9697660931     -126.0007870046     -336.2806309855
C        76.7130718374     -124.8850329500     -336.0133211211
C        76.4535281013     -124.6591829137     -334.7007408015
C        77.6824815587     -124.1976938842     -336.7014075923
C        75.2989334905     -126.4121644987     -335.1444511466
N        75.6207839434     -125.5687243677     -334.1851943555
H        75.2927693538     -125.6229535240     -333.2559209189
C        77.1164231349     -123.7252207007     -333.9468820125
C        78.3620972666     -123.2331162912     -335.9710320914
C        78.0840555263     -122.9997591025     -334.6249971958
C        73.3476229265     -126.8506280381     -338.0001273998
O        73.2693842357     -125.8516210176     -338.7190301684
N        72.3056628689     -127.3456614935     -337.3326641497
H        72.4740403266     -128.0063729906     -336.6245717770
C        70.9478934700     -126.8789075654     -337.5542922090
C        69.9781912896     -128.0720916320     -337.3735049853
O        70.4548843719     -129.0930221997     -338.2486199692
H        71.4170873840     -129.1677593055     -338.1431895005
C        68.5364919406     -127.7340374655     -337.7333434781
C        70.6335750142     -125.7040485065     -336.6317024687
O        70.3086779892     -125.8555875559     -335.4496431376
N        70.7825673725     -124.5006629062     -337.1859432152
H        71.1495482201     -124.4521271212     -338.0944426642
C        70.4828699181     -123.2663046139     -336.4737490005
C        71.1023288309     -122.0697599955     -337.2129719329
C        72.5930966431     -121.8346881197     -336.9866384477
C        73.1923963278     -120.6261768659     -336.7539340898
C        74.5004728270     -120.9643739563     -336.6281344076
C        72.7841698863     -119.3232727950     -336.9041699419
C        73.5300164134     -122.8502435806     -336.9929332198
N        74.6958719271     -122.2763802224     -336.7760769489
H        75.5566717046     -122.7389338446     -336.7345455967
C        75.5241616773     -120.0520116942     -336.6317137759
C        73.7938738648     -118.3718840291     -336.8904419169
C        75.1346248060     -118.7274797959     -336.7559240247
C        68.9923922134     -123.0294565647     -336.2285265501
O        68.3267192928     -122.2968596653     -336.9679640157
N        68.4191681943     -123.6370722445     -335.1820622416
H        68.9468504604     -124.2811863875     -334.6524045749
C        67.0295276732     -123.3713883775     -334.8205538251
C        66.4128230154     -124.5501885877     -334.0593612603
C        66.3362614333     -125.8521520617     -334.8498391863
C        65.5434137306     -126.9444033579     -334.1455369853
O        64.3405215759     -127.0434205869     -334.3830962763
O        66.1233295273     -127.7028515955     -333.3649996032
C        66.9112911993     -122.0681647735     -334.0268048834
O        66.6443148394     -122.0402985818     -332.8192350043
N        67.1565932231     -120.9519181482     -334.7215171539
H        67.3799692591     -121.0471364244     -335.6752094319
C        67.1492166446     -119.6232717229     -334.1229456419
C        68.2970492311     -119.4424457197     -333.1379427887
O        69.3792814611     -118.9664935849     -333.4845038669
N        68.0431111908     -119.8596852123     -331.8965798549
H        67.1587049322     -120.2513889339     -331.7271949675
C        69.0437980606     -119.8327683463     -330.8382807049
C        68.4449979917     -119.2209660869     -329.5708933573
C        69.4469077424     -118.6586209508     -328.5628743865
O        69.2294628669     -117.5747701539     -328.0294626043
N        70.5635317526     -119.2864271830     -328.2139083530
H        70.7911433346     -120.1504207134     -328.6239879607
H        71.1223695324     -118.8350350022     -327.5504480924
C        69.5329225039     -121.2498198706     -330.5435416505
O        70.6496416843     -121.4396819296     -330.0531606783
N        68.7266565751     -122.2769501594     -330.8339238989
H        67.8806845588     -122.1086456201     -331.3031075318
C        69.0902481110     -123.6586730345     -330.5596326550
C        67.8046034312     -124.4639033562     -330.3443940782
C        67.9966784419     -125.9159107795     -329.9322433975
C        66.6411025605     -126.5989841333     -329.8405336536
C        66.7842275209     -128.1109520723     -329.7243623729
N        67.2732003933     -128.6899564130     -330.9639368442
H        66.6521427834     -128.4279936830     -331.7703344324
H        68.2295690851     -128.3224816181     -331.2262409332
H        67.3249143259     -129.7224529794     -330.8954444799
C        69.9453681996     -124.1911165611     -331.7114618180
O        69.4903435087     -124.8908939474     -332.6259435321
N        71.2248380223     -123.8102048081     -331.6786505930
H        71.5081877159     -123.2126253380     -330.9503759991
C        72.1824058585     -124.1883838455     -332.7119713679
C        73.3954578206     -123.2448844766     -332.6919051093
C        73.1077253047     -121.7553724756     -332.8853223752
C        73.9568689218     -120.7255005201     -332.5854064785
C        73.2163001068     -119.6296856455     -332.8998724174
C        75.3152650030     -120.6576056857     -332.3921142217
C        71.9057548102     -121.2673522862     -333.3632106954
N        72.0050824839     -119.9548225061     -333.3616899095
H        71.2703665332     -119.3347126573     -333.5836412088
C        73.7485431035     -118.3733377143     -333.0412771010
C        75.8803454204     -119.3962973613     -332.5056749486
C        75.1136986016     -118.2771514023     -332.8214589529
C        72.6065620333     -125.6489480865     -332.5671168012
O        73.6841960913     -125.9912164454     -332.0690578117
N        71.7277417111     -126.5191537201     -333.0621287668
H        71.0324172883     -126.1750162155     -333.6681789071
C        71.7872763508     -127.9472769387     -332.7935007757
C        70.3786954649     -128.5430182253     -333.0211388840
O        69.4958348342     -127.7790819906     -332.2016693409
H        69.4889948011     -126.8524888537     -332.4953773637
C        70.2748453066     -130.0158258612     -332.6421354247
C        72.8521073493     -128.6578238065     -333.6255515656
O        72.7963851017     -128.6997986110     -334.8597307704
N        73.8552537217     -129.2117173717     -332.9382623587
H        73.8912302058     -129.0691647287     -331.9700113677
C        74.9289389109     -129.9638049708     -333.5758623935
C        76.1376581906     -130.0606062956     -332.6347496798
C        76.8163542171     -128.7258358072     -332.3509034508
C        76.5255542769     -127.8386187149     -331.3500957687
C        77.4203126290     -126.8428243076     -331.5725052260
C        75.7786238838     -127.9123819785     -330.1993003222
C        77.8543962900     -128.2597317733     -333.1341145767
N        78.2092395499     -127.0967775319     -332.6222397630
H        78.9369711447     -126.5295651808     -332.9523118485
C        77.6510970109     -125.8216034518     -330.6862333340
C        75.9782083251     -126.8857208084     -329.2876479938
C        76.8923239660     -125.8612305190     -329.5262694253
C        74.4949175393     -131.3470156049     -334.0627299367
O        74.8112059659     -132.3913543975     -333.4828635128
N        73.7303403876     -131.3557559496     -335.1569924570
H        73.4519650545     -130.4943858997     -335.5410818220
C        73.2851993775     -132.5876625444     -335.7882177819
C        72.0398167226     -132.2925362876     -336.6292274472
C        71.3541210994     -133.4955116010     -337.2681690720
C        70.2304479982     -133.0960958266     -338.2273521906
C        70.6990061969     -132.5944675176     -339.5983132923
N        71.2243522026     -131.2339761837     -339.5774383252
H        71.4375961940     -130.8199660695     -340.5313738211
H        72.0123194485     -131.0428514785     -338.8977430647
H        70.4697632439     -130.5990989184     -339.1969245029
C        74.4387421247     -133.1594599206     -336.6129586388
O        74.5588191710     -133.0014904643     -337.8289287870
N        75.3534355701     -133.8359792883     -335.9350681947
H        75.2421043630     -133.8782461029     -334.9573015286
H        76.0933473616     -134.2364322937     -336.4321116411
          147
Energy of minimum      3=     -425.1901905896 first found at step   223339
H       126.2433678838     -148.5986016176     -375.5129872330
H       127.7176888748     -149.2669500572     -375.0950045600
N       126.7464572411     -149.1426642574     -374.7572673930
H       126.6784954687     -148.5183146129     -373.9002297522
C       126.0628628053     -150.4076961174     -374.5520699453
C       124.6111517137     -150.0844945798     -374.2080124176
O       124.1860642196     -148.9228248280     -374.9191756484
H       123.3359736422     -148.6531768515     -374.5558333554
C       126.1629695126     -151.2976127078     -375.7879616023
O       126.4345224803     -150.7937962982     -376.8840423184
N       125.9678350963     -152.6113497220     -375.6453279438
H       125.7573781134     -152.9631627795     -374.7572854450
C       126.0441464724     -153.5313386756     -376.7728692194
C       126.1497083933     -154.9743553570     -376.2548511844
C       126.5570549356     -156.0303836442     -377.2826935393
C       126.2805521558     -157.3682749100     -377.2331125259
C       126.8585599527     -157.8361999991     -378.3680977164
C       125.7734747824     -158.2019944401     -376.2669668466
C       127.2832044814     -155.7338613448     -378.4206451256
N       127.4582724638     -156.8678883637     -379.0675504369
H       127.9523926939     -156.9596916051     -379.9169625015
C       126.9789455838     -159.1698142437     -378.6630530705
C       125.8652988603     -159.5590935751     -376.5418960957
C       126.4521545283     -160.0329040484     -377.7143622093
C       124.8462661410     -153.3239928675     -377.7014365637
O       123.7300378696     -153.7968716528     -377.4747702655
N       125.1127965919     -152.5791001963     -378.7739767732
H       126.0532005436     -152.4091377678     -379.0042779662
C       124.0721607359     -152.0879220219     -379.6607758295
C       124.4790031408     -150.6857317896     -380.1734968974
O       124.7323803754     -149.9079619954     -379.0053246876
H       125.2937038508     -150.4232097771     -378.4026429863
C       123.3936209436     -150.0096819033     -381.0026330988
C       123.8174165241     -153.0831567021     -380.7893946091
O       124.5691300590     -153.1889252410     -381.7638309591
N       122.7469646763     -153.8600284439     -380.6216997395
H       122.2588753440     -153.7979978323     -379.7729813406
C       122.3209231764     -154.8321790428     -381.6179038091
C       121.3409948975     -155.8341950698     -380.9875145431
C       121.9620930826     -156.9480562466     -380.1490564663
C       121.6055681345     -158.2694547391     -380.1736911226
C       122.4464258097     -158.8194346087     -379.2616892186
C       120.5179363199     -158.9467676388     -380.6687496329
C       122.9869762977     -156.7364194717     -379.2468173375
N       123.2551990154     -157.9105256861     -378.7128734771
H       123.9322522126     -158.0806507394     -378.0278089561
C       122.2979044297     -160.0867897161     -378.7595846449
C       120.3504221613     -160.2408231203     -380.1973786707
C       121.2215688803     -160.7998117241     -379.2642165015
C       121.7155788276     -154.2090404496     -382.8756564959
O       120.4926878479     -154.1011491576     -383.0152399500
N       122.5474631063     -153.7797026211     -383.8330005904
H       123.5202904295     -153.7997121185     -383.6684543470
C       122.0401193875     -153.2759091214     -385.1064271259
C       123.0317675543     -152.3088076350     -385.7628812737
C       123.3203506024     -151.0436797693     -384.9616333439
C       124.1475002406     -150.0180620439     -385.7243783311
O       125.3782977618     -150.0782013535     -385.6749808043
O       123.5593786944     -149.1490523869     -386.3663230711
C       121.6798245036     -154.4302506441     -386.0446544962
O       122.3399215441     -154.7046657191     -387.0542317235
N       120.6178672543     -155.1553716216     -385.6768894642
H       120.1482671736     -154.8924451436     -384.8529733482
C       120.1626405958     -156.3290848217     -386.4107486946
C       121.1649548591     -157.4724684969     -386.3191237962
O       121.0837385294     -158.3363582388     -385.4445038577
N       122.1357363278     -157.4436071654     -387.2336212645
H       122.1294884894     -156.6965237504     -387.8709004902
C       123.2229726837     -158.4129837794     -387.2563969554
C       123.4091810871     -158.9526272824     -388.6753066566
C       124.1209855517     -160.3003769498     -388.7891614044
O       123.6842534801     -161.1562162460     -389.5529411478
N       125.2133002909     -160.6102787649     -388.1010557284
H       125.5934533531     -159.9646437755     -387.4645885913
H       125.5884256113     -161.4983725256     -388.2647403289
C       124.5192754692     -157.7588529740     -386.7807902499
O       125.4254662525     -158.4407798483     -386.2935769190
N       124.6458638183     -156.4325097791     -386.8998379185
H       123.8804091378     -155.9005053074     -387.2083484142
C       125.8543718980     -155.7234400390     -386.5084911063
C       125.9659685155     -154.4543920811     -387.3593595981
C       127.2395882843     -153.6443348233     -387.1705461094
C       127.1617094028     -152.3775914703     -388.0082697405
C       128.2608550253     -151.3923357570     -387.6328284691
N       128.0405356590     -150.8393890259     -386.3074868682
H       127.0909870476     -150.3939038028     -386.2402914529
H       128.0442697869     -151.5862603634     -385.5586718544
H       128.7644742074     -150.1358011663     -386.0744682096
C       125.8046047927     -155.4358914297     -385.0062712916
O       125.4641367460     -154.3421236503     -384.5364136334
N       126.1218992885     -156.4744034138     -384.2290773460
H       126.3342685596     -157.3290050508     -384.6676289290
C       126.0907260532     -156.4009350478     -382.7727122636
C       126.0033492330     -157.8108970372     -382.1673319747
C       124.8099634949     -158.6672538063     -382.5947100475
C       124.7036325361     -160.0247370183     -382.4621818298
C       123.4933830849     -160.2834920487     -383.0247503465
C       125.3526243487     -160.9423848426     -381.6722808130
C       123.6878556421     -158.1529367115     -383.2173061561
N       122.8952058287     -159.1735301539     -383.4677018862
H       122.0500958060     -159.1185978368     -383.9740393450
C       122.8243492354     -161.4703438274     -382.8651740947
C       124.7122042163     -162.1616895699     -381.5102047747
C       123.4753750224     -162.4216815653     -382.0955356786
C       127.2914645993     -155.6270810740     -382.2292003444
O       128.2907527608     -156.1774936636     -381.7548853637
N       127.1476177152     -154.3036544773     -382.2788991049
H       126.2413163554     -153.9452585114     -382.4180882728
C       128.2516122515     -153.3773556797     -382.0827925711
C       127.9072853750     -152.0518478291     -382.8015925294
O       127.6032717198     -152.4053282975     -384.1491687503
H       126.8161252095     -152.9750431753     -384.1705410812
C       129.0478460222     -151.0403918535     -382.7886559367
C       128.5840049686     -153.1530339379     -380.6097149646
O       127.7670988757     -152.6532556403     -379.8280812579
N       129.8021502611     -153.5376098207     -380.2176810162
H       130.3717637120     -154.0078348159     -380.8607630603
C       130.2980539408     -153.3137187976     -378.8657599799
C       131.4986869556     -154.2225744333     -378.5775905510
C       131.1632400849     -155.7016638290     -378.4289551656
C       130.8790062933     -156.3702589287     -377.2689868319
C       130.7289003127     -157.6491417398     -377.6974631173
C       130.5221639412     -155.9722766651     -376.0033052589
C       131.1762955094     -156.5681786894     -379.5046807514
N       130.8976111952     -157.7628357297     -379.0193749297
H       130.8159604127     -158.5848348204     -379.5465573948
C       130.2252148244     -158.6553653701     -376.9129592814
C       130.0220539202     -156.9701674969     -375.1792415902
C       129.8787656983     -158.2835044481     -375.6227982197
C       130.6433810458     -151.8504908254     -378.5857617194
O       131.8051302752     -151.4297706027     -378.5696317996
N       129.6015405279     -151.0430043003     -378.3745771433
H       128.6953022673     -151.4139253677     -378.4647192866
C       129.7612005066     -149.6386834492     -378.0311997052
C       128.4709787941     -148.8927713128     -378.3816277215
C       128.4876415151     -147.3798108512     -378.1903008076
C       127.1041809143     -146.7475783585     -378.3580653587
C       126.1532015386     -146.9521596314     -377.1724617502
N       125.5801579156     -148.2905851156     -377.1086909967
H       124.8327476278     -148.4139351359     -376.3672372277
H       126.2765030907     -149.0857426725     -377.0574532053
H       125.0811848215     -148.4888078236     -378.0180557918
C       130.1286594615     -149.5287270276     -376.5506934368
O       129.3189662162     -149.2715353600     -375.6583899334
N       131.3989834286     -149.7557428832     -376.2530042901
H       131.9901061223     -150.0189004940     -376.9956554919
H       131.6762743912     -149.6708374580     -375.3198456502
          147
Energy of minimum      4=     -425.0140572314 first found at step   207581
H        99.7718111261     -112.7087891257     -352.0489669023
H       100.7748245124     -112.7045782623     -350.7114438366
N       100.1641100944     -113.3194774369     -351.2786573283
H        99.3046749910     -113.6558229642     -350.7521710625
C       100.8281321059     -114.4400627057     -351.9377043439
C       101.3580549608     -115.4075860131     -350.8804773084
O       100.5874771807     -115.2059513063     -349.7058337954
H       100.6231695716     -114.2482167365     -349.6092182326
C        99.8484776135     -115.1446326311     -352.8737893604
O        98.6451427200     -114.8636084059     -352.8293433955
N       100.3297762956     -116.0481362210     -353.7319033303
H       101.2898912639     -116.2348505790     -353.7308811177
C        99.4700180957     -116.7887495459     -354.6420703420
C       100.2641671568     -117.2098587213     -355.8888441330
C       100.4759330652     -116.1223071270     -356.9431605902
C       100.5135989174     -116.3075119709     -358.2970976466
C       100.6841708904     -115.0462736929     -358.7676520995
C       100.6006701667     -117.4136387918     -359.1061435320
C       100.6260175324     -114.7824222184     -356.6392929640
N       100.7574877050     -114.1442024147     -357.7840827420
H       100.8889217017     -113.1700301384     -357.8723832113
C       100.9434927942     -114.7565213607     -360.0824958358
C       100.8468063214     -117.1541987812     -360.4469804683
C       101.0118965610     -115.8552183789     -360.9254863244
C        98.8016876774     -117.9831722246     -353.9622779065
O        99.2807429850     -119.1181660449     -354.0193090429
N        97.6450172036     -117.7151306641     -353.3568745611
H        97.2200287071     -116.8444913766     -353.5231799063
C        96.9511445064     -118.7174354545     -352.5573592928
C        96.0482262077     -118.0840465655     -351.4624122683
O        96.5003719014     -116.7592862149     -351.1945496653
H        96.1925636417     -116.2021676447     -351.9287306333
C        96.0674044681     -118.9119936201     -350.1873506399
C        96.1263578161     -119.6260711781     -353.4709723579
O        94.9299439927     -119.4118039855     -353.6911312912
N        96.7911392020     -120.6324608467     -354.0390955619
H        97.7622909265     -120.6777261540     -353.9078808768
C        96.1228747390     -121.6190379496     -354.8796785106
C        97.1475912917     -122.3877888339     -355.7274233792
C        97.6626686808     -121.6528717961     -356.9608135330
C        97.5570858915     -122.0681270566     -358.2609005393
C        98.1872082948     -121.0765796646     -358.9399045792
C        97.2359035170     -123.2678392215     -358.8476809586
C        98.3351973282     -120.4481039782     -356.8869833382
N        98.6501091931     -120.1262353097     -358.1250447069
H        99.1429134103     -119.3256692218     -358.3950352732
C        98.5520020637     -121.1723792257     -360.2582765000
C        97.5719067191     -123.3900734252     -360.1882001917
C        98.2147247179     -122.3648320097     -360.8794465729
C        95.2340690934     -122.5831303822     -354.0920079369
O        95.6029293268     -123.7289039165     -353.8132041420
N        94.0339753907     -122.1419382950     -353.6945223567
H        93.7911975482     -121.1991343114     -353.8559175696
C        93.0980637016     -123.0070904028     -352.9824706510
C        92.1398124486     -122.1818913997     -352.1161324515
C        92.8120493042     -121.3729391638     -351.0113168268
C        91.8267587616     -120.6784995401     -350.0814837299
O        91.4674385458     -119.5269574019     -350.3381906526
O        91.4228330427     -121.2862770101     -349.0912409086
C        92.3372264203     -123.9298815357     -353.9372145025
O        91.1261507238     -123.8110965410     -354.1596188561
N        93.0782833594     -124.8631493755     -354.5443804620
H        94.0394191454     -124.8910655191     -354.3347831705
C        92.5363564945     -125.8046697957     -355.5157777430
C        92.0844856941     -125.1077583761     -356.7924865514
O        92.8302033690     -124.9929551802     -357.7664408576
N        90.8425240995     -124.6220392885     -356.7583746569
H        90.3377446179     -124.7395596745     -355.9242978560
C        90.2615700611     -123.8677710592     -357.8605151204
C        88.8667899442     -124.4068864010     -358.1818286161
C        88.3372003830     -124.0993473643     -359.5822683780
O        87.7636026781     -124.9763670830     -360.2213147736
N        88.4554124117     -122.9121788333     -360.1649000690
H        88.9193734908     -122.1801387643     -359.7009399472
H        88.0675820791     -122.8304341711     -361.0588431263
C        90.1688472782     -122.3875693843     -357.4940273498
O        90.1602721010     -121.5248879103     -358.3768013686
N        90.1024529714     -122.0485346128     -356.2017307709
H        90.1988912150     -122.7436373479     -355.5149555497
C        89.9875647647     -120.6656413123     -355.7618316355
C        89.2917019764     -120.6356177430     -354.3964601628
C        89.0073396453     -119.2464405610     -353.8412247886
C        88.4220063733     -119.3627683854     -352.4429012079
C        88.3870187845     -118.0121458948     -351.7385529351
N        89.7253524009     -117.5473747242     -351.4148324811
H        90.2426205920     -118.2635357373     -350.8456309847
H        90.3183883773     -117.3961256930     -352.2773828224
H        89.6873654206     -116.6568861050     -350.8863408215
C        91.3805781832     -120.0342542172     -355.7315666067
O        92.0454926732     -119.9070936397     -354.6948739938
N        91.8485684690     -119.6607855085     -356.9251827859
H        91.2883028396     -119.8368814192     -357.7144006335
C        93.1752882631     -119.0838350640     -357.0956586494
C        93.6332213577     -119.1925676779     -358.5571622087
C        93.7315380248     -120.6072392375     -359.1274968083
C        93.7454953376     -120.9424494156     -360.4537961720
C        93.7838179028     -122.3008393281     -360.4157243652
C        94.0357966191     -120.2357095257     -361.5954858902
C        93.7626829707     -121.7439325175     -358.3412192485
N        93.7963199845     -122.7703751963     -359.1645580011
H        93.7497011420     -123.7160885221     -358.8869627545
C        94.1017467813     -123.0783287596     -361.5002147656
C        94.3390141378     -120.9942793629     -362.7160846340
C        94.3695306480     -122.3860305293     -362.6707857031
C        93.2539897191     -117.6464447640     -356.5890983217
O        93.2183237365     -116.6607675556     -357.3331910095
N        93.4346069543     -117.5547227015     -355.2724418262
H        93.7135038929     -118.3661108257     -354.7896693569
C        93.3730897099     -116.2858242373     -354.5669403103
C        92.8643606196     -116.5427785285     -353.1280588454
O        91.7009427511     -117.3613494571     -353.2513261204
H        91.9422001207     -118.2049242307     -353.6702605032
C        92.5003389767     -115.2568760065     -352.3971701793
C        94.7620441331     -115.6453807031     -354.6205952561
O        95.5742401420     -115.7071007202     -353.6907600850
N        95.0616623467     -115.0763897859     -355.7918960040
H        94.4091340928     -115.1367751318     -356.5196913274
C        96.3512287556     -114.4497592018     -356.0435107910
C        96.6363510963     -114.3843044131     -357.5525897428
C        96.7086922876     -115.7177861722     -358.3008944191
C        96.6757798637     -115.8728646040     -359.6603804408
C        96.7677656132     -117.2192086519     -359.8037725737
C        96.8097136674     -115.0097030524     -360.7208944966
C        96.8189404431     -116.9414879364     -357.6695440253
N        96.8596580811     -117.8481517478     -358.6269858974
H        96.9555089950     -118.8138126610     -358.4906689502
C        96.9873904651     -117.8382374877     -361.0080148908
C        97.0187418459     -115.6052147161     -361.9564713474
C        97.1033569086     -116.9890210106     -362.0980636358
C        96.4429715072     -113.0674709351     -355.4039378888
O        96.1218363950     -112.0347375235     -356.0016509407
N        96.8456025531     -113.0454770604     -354.1313540651
H        97.0251805310     -113.9014013792     -353.6817752184
C        96.9926055770     -111.8015176441     -353.3885537178
C        96.9362523365     -112.0310350233     -351.8749858496
C        95.8784849038     -113.0054846914     -351.3665962500
C        96.0337066736     -113.2963565039     -349.8723128464
C        97.4460037256     -113.7084425900     -349.4361966874
N        97.9872582914     -114.8179231272     -350.2122296297
H        98.0442216846     -114.6742791922     -351.2568704624
H        98.9006319933     -115.2119538948     -349.8493965507
H        97.3148217545     -115.6326127162     -350.1653270121
C        98.3454742128     -111.2085761973     -353.7651364672
O        99.3658027223     -111.3890759683     -353.0985737824
N        98.3948535513     -110.4949494339     -354.8796662028
H        97.5650631387     -110.4348941492     -355.4069706769
H        99.2470101413     -110.0864586386     -355.1283601367
          147
Energy of minimum      5=     -424.8462659446 first found at step   219809
H       108.6288017611     -158.7242188748     -390.4112811381
H       107.0496817644     -158.8564486972     -390.9441196183
N       107.6224450097     -158.7649022750     -390.0860020519
H       107.5859004455     -159.6263138713     -389.4650516873
C       107.3691822341     -157.5498203162     -389.3132196352
C       106.0176671660     -157.6769291172     -388.6120974463
O       105.6987078506     -159.0607216277     -388.5605654732
H       105.7966371239     -159.3186365414     -389.4838096060
C       108.4749285018     -157.3386446175     -388.2821520834
O       109.1621464600     -158.3037786219     -387.9282979375
N       108.6797307114     -156.1116735057     -387.7954029805
H       108.1113673056     -155.3794959913     -388.1077540253
C       109.7038993373     -155.8415800737     -386.7942880771
C       109.9569582277     -154.3296026270     -386.6908858991
C       111.2510698180     -153.9057220709     -385.9919196044
C       111.5582812419     -152.6525888649     -385.5400972805
C       112.8058607872     -152.8146331188     -385.0316435237
C       110.9775167915     -151.4169736451     -385.6871376589
C       112.3016196916     -154.7713355466     -385.7527319715
N       113.2480155573     -154.0689875720     -385.1643488075
H       114.1227800350     -154.4293904728     -384.8833143791
C       113.5926767917     -151.7746144637     -384.6082051140
C       111.7417840297     -150.3430696304     -385.2531312402
C       113.0193737818     -150.5174063134     -384.7230898518
C       109.2802634571     -156.4504094716     -385.4579894196
O       108.4638662350     -155.9155237578     -384.7040992691
N       109.8606743314     -157.6186573255     -385.1849212180
H       110.6446145268     -157.8871376192     -385.7137326786
C       109.4401030246     -158.4483064027     -384.0700959885
C       109.6161789632     -159.9336448714     -384.4651817397
O       108.9010321356     -160.0921092704     -385.6898721293
H       109.1243364572     -159.3515331431     -386.2768704818
C       109.0575972338     -160.8990249946     -383.4273493535
C       110.2255971236     -158.0524823204     -382.8231864892
O       111.3651617614     -158.4698391868     -382.5929863481
N       109.6099894151     -157.1739995756     -382.0314708539
H       108.7537580114     -156.8012490994     -382.3320149933
C       110.2042444473     -156.6900869691     -380.7931237578
C       109.4693637106     -155.4322729847     -380.3032486097
C       109.3837572001     -154.2823092448     -381.3000877692
C       108.2533169318     -153.8058833829     -381.9074872086
C       108.7282055104     -152.7709112853     -382.6454442227
C       106.9900818045     -154.3144703714     -382.0873620129
C       110.4877067836     -153.5402274459     -381.6740143598
N       110.0475765472     -152.6217616272     -382.5096403465
H       110.6000745893     -151.9484737301     -382.9547092004
C       108.0019122418     -152.1383876049     -383.6215428105
C       106.2200376587     -153.6829587463     -383.0533103798
C       106.7138909832     -152.6173837074     -383.8035205033
C       110.2170632306     -157.7514904394     -379.6907999550
O       109.3373384779     -157.7858695397     -378.8239153855
N       111.2052278738     -158.6550388366     -379.6897650500
H       111.8512478806     -158.6611917316     -380.4357470469
C       111.3273288260     -159.6421238790     -378.6201267331
C       112.0761966465     -160.8923369411     -379.0949656394
C       111.3870049203     -161.6627695503     -380.2160496486
C       112.0543233587     -162.9923262537     -380.5392808492
O       111.6673399223     -164.0022543331     -379.9532004330
O       112.9552851836     -163.0256263631     -381.3806873788
C       111.9829187335     -159.0345866276     -377.3780278630
O       113.1280572144     -159.3277300071     -377.0133324660
N       111.2447635179     -158.1290373201     -376.7269425539
H       110.3483682722     -157.9302755961     -377.0811482503
C       111.7244738323     -157.4015399472     -375.5591755939
C       112.8540487881     -156.4457307566     -375.9200293669
O       112.6383078977     -155.2688959797     -376.2139296755
N       114.0720964248     -156.9897069963     -375.9177796337
H       114.1364825218     -157.9444647490     -375.6973492819
C       115.2649309713     -156.2508704494     -376.3089937241
C       116.3762399869     -156.4756744901     -375.2824741119
C       117.4812460126     -155.4201234466     -375.2519379076
O       117.8920590841     -155.0009291168     -374.1739684881
N       118.0438033387     -154.9186807653     -376.3450488602
H       117.7393443802     -155.2098569732     -377.2332738526
H       118.7498035032     -154.2574291427     -376.2016330789
C       115.7374690575     -156.7111784625     -377.6871422407
O       116.3999448186     -155.9581643049     -378.4066409356
N       115.4120989749     -157.9422784470     -378.0969109141
H       114.8120081651     -158.4911209370     -377.5466461662
C       115.8424316731     -158.4796130506     -379.3789540870
C       115.9234609983     -160.0053144196     -379.2640898040
C       116.4726609069     -160.7286246372     -380.4849621242
C       116.4126126536     -162.2304869867     -380.2544227692
C       116.6697997870     -163.0031909895     -381.5416559992
N       115.5693259010     -162.8482974115     -382.4775938779
H       114.6598132580     -163.1363114173     -382.0366280104
H       115.4273042655     -161.8401628084     -382.7639640222
H       115.7275357649     -163.4133525302     -383.3314983716
C       114.8783698717     -158.0113128765     -380.4713409148
O       113.9636190355     -158.7157073363     -380.9186350214
N       115.0750573877     -156.7568126556     -380.8845679519
H       115.7883451599     -156.2363118894     -380.4508956534
C       114.2350273916     -156.1181945427     -381.8912215248
C       114.3789878798     -154.5901489468     -381.8034910596
C       113.8860476112     -153.9299399108     -380.5133008923
C       113.9590369391     -152.5978543944     -380.2102309219
C       113.3986538730     -152.5443605591     -378.9727938670
C       114.1492171413     -151.4724172720     -380.9747139452
C       113.2963180652     -154.6298612171     -379.4771526166
N       113.0060127268     -153.7477876964     -378.5442690023
H       112.6420774825     -153.9692332989     -377.6542582635
C       112.9869832095     -151.3779856927     -378.3796792471
C       113.7639875181     -150.2737801386     -380.3933553933
C       113.1967858213     -150.2264811585     -379.1221356636
C       114.5293537256     -156.6371729365     -383.2978606315
O       115.1836279174     -155.9966198107     -384.1273921405
N       113.9807100381     -157.8213064713     -383.5651389986
H       113.2690323329     -158.1433066311     -382.9659443819
C       114.3496097866     -158.6247764898     -384.7203635814
C       113.9795876745     -160.0977165641     -384.4279449179
O       114.6156315077     -160.4225874746     -383.1932283030
H       114.2513115027     -159.8723905395     -382.4796331577
C       114.4471110279     -161.0656874176     -385.5086896859
C       113.7177621790     -158.1217218226     -386.0162709580
O       112.4940427901     -158.1228069256     -386.1911275924
N       114.5690091341     -157.6635618037     -386.9387324468
H       115.5190688615     -157.6056293033     -386.7081768467
C       114.1353588294     -157.1878154817     -388.2466436527
C       115.2269659263     -156.3148790103     -388.8803627669
C       115.4979792654     -155.0131243704     -388.1360564235
C       116.3974610546     -154.8025991111     -387.1261324576
C       116.2191930333     -153.4870160901     -386.8448375864
C       117.4534459712     -155.5249669404     -386.6253762638
C       114.8154522003     -153.8502369189     -388.4361456832
N       115.2895589215     -152.9244359186     -387.6246609599
H       115.0124809549     -151.9845732261     -387.6121459008
C       117.0586421910     -152.7665852678     -386.0337051216
C       118.3139729171     -154.8284449300     -385.7891182058
C       118.1200899609     -153.4796058100     -385.4972785695
C       113.7120417465     -158.3126529199     -389.1923815602
O       114.4122050341     -158.6914584244     -390.1374766414
N       112.5327751010     -158.8769427843     -388.9222478791
H       112.0460944770     -158.5842288012     -388.1194799653
C       111.9540149513     -159.9127061141     -389.7628645781
C       110.9385432623     -160.7116054540     -388.9409632233
C       110.3213670430     -161.9258885149     -389.6268619714
C       109.1934305130     -162.5590168069     -388.8091014926
C       107.8576643170     -161.8082501919     -388.8611976821
N       107.8328078886     -160.5987700499     -388.0464542272
H       108.5875202894     -159.8831832724     -388.2408889771
H       108.0641791468     -160.8733929575     -387.0522586358
H       106.8824056620     -160.1334334310     -387.9620310473
C       111.3348748716     -159.2536123639     -390.9958697361
O       110.1356485960     -158.9941854169     -391.1077189487
N       112.1787830641     -158.9368062129     -391.9660917898
H       113.1341495769     -159.1086388470     -391.7988878822
H       111.8162113085     -158.5353458829     -392.7798826609
          147
Energy of minimum      6=     -424.6808696372 first found at step   209799
H       122.4398531713     -164.9859713344     -391.4118178216
H       123.1628096804     -164.0070851616     -390.2654595520
N       123.0980533169     -164.9908476464     -390.5829847119
H       122.6216129482     -165.6272287401     -389.8780248000
C       124.4316011326     -165.5019831371     -390.8765778583
C       125.1546119776     -164.4915365135     -391.7651069907
O       124.5216088261     -163.2227642203     -391.6284932765
H       123.6707039576     -163.3199814876     -392.0655209988
C       125.2068138975     -165.7128586088     -389.5785019999
O       124.8518286351     -165.1106089604     -388.5585776158
N       126.2431767476     -166.5556287367     -389.5743429136
H       126.4844526851     -167.0104755761     -390.4059584037
C       127.0323990937     -166.8006401734     -388.3738165369
C       127.8898474916     -168.0614606548     -388.5656416264
C       128.5278659978     -168.6388517643     -387.3017390002
C       129.6523518598     -169.4133965679     -387.2348286374
C       129.7782389973     -169.6449087861     -385.9037415604
C       130.4235207966     -170.0576327624     -388.1707300146
C       128.0136810978     -168.4317166723     -386.0356973768
N       128.8027842255     -169.0683782086     -385.1947866194
H       128.6725761117     -169.1007521304     -384.2169925364
C       130.6853495514     -170.5235642082     -385.3697627158
C       131.3634189866     -170.9429321697     -387.6622300958
C       131.4937760712     -171.1692500411     -386.2927922627
C       127.8674066594     -165.5642521867     -388.0348541574
O       128.9316722352     -165.2962851548     -388.5974285652
N       127.3376816273     -164.7955131107     -387.0837086916
H       126.6088444608     -165.1632265783     -386.5361060534
C       127.8535225495     -163.4737188629     -386.7711537530
C       126.6706416472     -162.5618524056     -386.3647108277
O       125.7335305126     -162.6428679358     -387.4366629975
H       125.6074832812     -163.5771517397     -387.6703274839
C       127.0763861554     -161.1072014308     -386.1603010868
C       128.9320214032     -163.5617889833     -385.6948678944
O       128.6642726833     -163.7075279484     -384.4978477611
N       130.1846341509     -163.5134848591     -386.1489014249
H       130.3247650112     -163.5085328556     -387.1198497929
C       131.3398017639     -163.5323498530     -385.2631424512
C       132.6079201116     -163.8722380578     -386.0618107285
C       132.8246495922     -165.3478690809     -386.3854740575
C       134.0075453172     -166.0295248982     -386.2859053309
C       133.6619509520     -167.2804954706     -386.6820165794
C       135.3178865479     -165.6370545352     -386.1604002297
C       131.8161325217     -166.1834015557     -386.8259169897
N       132.3698469232     -167.3652104549     -387.0056194164
H       131.9073095299     -168.1654901849     -387.3254138459
C       134.5729080862     -168.2600610287     -386.9836206055
C       136.2660586772     -166.6112522700     -386.4374192784
C       135.9024006046     -167.8952319841     -386.8390477126
C       131.5365583747     -162.2415375603     -384.4681153383
O       132.3258941421     -161.3684872737     -384.8440390849
N       130.8291219810     -162.0767113951     -383.3432881411
H       130.1454683112     -162.7467033211     -383.1032937124
C       131.0451062877     -160.9219857234     -382.4756583609
C       129.7961763243     -160.6007117109     -381.6470919778
C       128.5666662705     -160.2151197277     -382.4627831869
C       127.4083250448     -159.7114240753     -381.6128590807
O       127.3130415578     -158.5024456065     -381.4068252282
O       126.5951341181     -160.5207830029     -381.1605703969
C       132.2701230367     -161.1323923438     -381.5825696650
O       132.1857823502     -161.3279929985     -380.3640029058
N       133.4472543379     -161.1309301921     -382.2175220348
H       133.4410979149     -160.9864357286     -383.1909570779
C       134.7155790148     -161.3765946138     -381.5434388308
C       134.8165285198     -162.8113665451     -381.0418612324
O       135.3292304302     -163.7008780118     -381.7228661641
N       134.2878683277     -163.0237057878     -379.8356333505
H       133.8763519898     -162.2546003701     -379.3846027130
C       134.2277676811     -164.3452109810     -379.2254702789
C       134.7279042844     -164.2748799220     -377.7818239018
C       135.2086413052     -165.5934610117     -377.1766009672
O       136.2454573132     -165.6191081972     -376.5201629549
N       134.5562359758     -166.7415390403     -377.3143079177
H       133.7287039971     -166.7766486267     -377.8438434350
H       134.9530522214     -167.5185302035     -376.8726708254
C       132.7924975164     -164.8686777402     -379.2475111400
O       132.5653317994     -166.0815390960     -379.2167557169
N       131.7911688784     -163.9836465519     -379.3061965969
H       131.9960997161     -163.0299078909     -379.4180637944
C       130.3922499451     -164.3828939199     -379.2961497996
C       129.5689783643     -163.2414354175     -378.6909309072
C       128.0891797174     -163.5309438908     -378.4897857297
C       127.3956043140     -162.2810747884     -377.9708786207
C       125.8799503464     -162.4166590700     -378.0359339369
N       125.4111533572     -162.4192018505     -379.4110901016
H       125.7383840603     -161.5599679577     -379.9202538198
H       125.8047289026     -163.2298779840     -379.9646695065
H       124.3768450546     -162.4652483590     -379.4498988471
C       129.9619494048     -164.7432406437     -380.7197926128
O       129.3432228595     -163.9654431127     -381.4581835174
N       130.3402318420     -165.9577715507     -381.1260320015
H       130.8730126681     -166.5048587776     -380.5058608044
C       130.0561484589     -166.4591302971     -382.4659230295
C       131.0049153321     -167.6161692628     -382.8167642096
C       132.5034078242     -167.3130132681     -382.7642161246
C       133.5107859610     -168.2365974562     -382.7024730339
C       134.6229275901     -167.4578407004     -382.6330457474
C       133.5745053955     -169.5748002040     -383.0063887429
C       133.0202110792     -166.0311359252     -382.7329288310
N       134.3283145794     -166.1544568134     -382.6538092093
H       134.9584891535     -165.4035138561     -382.5416895727
C       135.8920174402     -167.9323026896     -382.8474863908
C       134.8463809597     -170.0900206275     -383.2063664182
C       135.9816222996     -169.2869993097     -383.1267522056
C       128.5904229123     -166.8684970541     -382.6076909420
O       128.2085306505     -168.0421628589     -382.5513666271
N       127.7652928932     -165.8477317850     -382.8353278608
H       128.1602507720     -164.9942424381     -383.1264767165
C       126.3190417937     -165.9562508762     -382.7264143631
C       125.7468749341     -164.5494062503     -382.4338063604
O       126.4394516365     -164.0780504909     -381.2798530542
H       127.3861565668     -163.9846663169     -381.4790772886
C       124.2473058352     -164.5491008355     -382.1592976034
C       125.6754014074     -166.5848695803     -383.9599000952
O       125.7453917992     -166.0523228306     -385.0732555942
N       125.0442392539     -167.7461936722     -383.7638698186
H       125.0986297284     -168.1625148096     -382.8790851376
C       124.3113798753     -168.4285064098     -384.8223951667
C       124.0797307875     -169.8982694965     -384.4530991614
C       125.3285882736     -170.7711274855     -384.4798305205
C       125.7931872522     -171.5138200922     -385.5314436965
C       126.8739725095     -172.1356564959     -384.9958247167
C       125.5361031324     -171.5186909080     -386.8810955854
C       126.1192541917     -170.9542447712     -383.3620114615
N       127.0692675243     -171.7981908692     -383.7164430954
H       127.7977235631     -172.1081329404     -383.1388979292
C       127.7931204384     -172.8300459378     -385.7405540108
C       126.4400066423     -172.2250354957     -387.6614883349
C       127.5430722574     -172.8688541254     -387.1039295787
C       122.9924697374     -167.7436836398     -385.1827151604
O       121.8955484955     -168.1634509517     -384.7986759109
N       123.0998648820     -166.6447425766     -385.9329550556
H       123.9992583097     -166.3153212776     -386.1555508758
C       121.9376844866     -165.9197120179     -386.4220534097
C       122.3533220538     -164.4857268055     -386.7638641556
C       121.2414253175     -163.5363865163     -387.1977339969
C       121.7715534894     -162.1777563189     -387.6631378902
C       122.3876770423     -162.1629088534     -389.0676082839
N       123.7164499170     -162.7591795624     -389.1318939964
H       123.7874427864     -163.7645751508     -388.8051394867
H       124.3446696624     -162.2561626622     -388.4473667004
H       124.2062464510     -162.6463615543     -390.0654320652
C       121.3547776893     -166.6742272693     -387.6177017629
O       121.5920522451     -166.3897433240     -388.7927447058
N       120.5742960389     -167.7034748624     -387.3255103987
H       120.4688072354     -167.9255293171     -386.3716903391
H       120.1644463592     -168.1956157254     -388.0635516357
          147
Energy of minimum      7=     -424.4983547844 first found at step   204683
H       111.4366068454     -155.3816582929     -382.1273717330
H       111.2621034074     -154.5843828052     -380.6682891847
N       110.8316566532     -154.6881120678     -381.6046438570
H       110.8869633435     -153.8034733562     -382.1905622121
C       109.4752804960     -155.2028421585     -381.5373191765
C       109.0169977941     -155.4556027864     -382.9712734816
O       110.1178105165     -155.8906754058     -383.7679379078
H       109.8355355473     -155.8759577321     -384.6885231966
C       109.4097533402     -156.4729965122     -380.6938633091
O       110.4401308133     -157.1250621859     -380.4886864464
N       108.2311081426     -156.8384609063     -380.1824358769
H       107.4443701593     -156.2887867963     -380.3710777787
C       108.0817708618     -158.0355855499     -379.3653376548
C       106.7364401286     -157.9930617000     -378.6240074414
C       106.5787343448     -158.9676293028     -377.4557173546
C       105.4040877718     -159.3913060046     -376.8993284760
C       105.8225196634     -160.2262784158     -375.9149636506
C       104.0932803828     -159.0029015078     -377.0280884340
C       107.6523012892     -159.5431700264     -376.8027553792
N       107.1551077869     -160.3101928349     -375.8542685884
H       107.6943147842     -160.8414081880     -375.2209049052
C       104.9855068145     -160.7670892969     -374.9731826801
C       103.2163324464     -159.5453087607     -376.0993836884
C       103.6514099679     -160.4099746853     -375.0960726119
C       108.2332606907     -159.2838163030     -380.2358682110
O       107.3221035607     -159.7308317280     -380.9365303297
N       109.4417204684     -159.8426965836     -380.1765060057
H       110.0493374050     -159.5690758949     -379.4538589023
C       109.8547905206     -160.9006948687     -381.0819721278
C       111.3654900749     -160.7374657583     -381.3763688075
O       111.5238932022     -159.4004901595     -381.8479336336
H       111.0386338533     -158.8001387597     -381.2580467399
C       111.8802251937     -161.7076631591     -382.4328428279
C       109.5005224346     -162.2657743603     -380.4977380644
O       110.1925458277     -162.8210237417     -379.6383265388
N       108.3619601921     -162.7908700899     -380.9510248671
H       107.8072303353     -162.2459885602     -381.5491726903
C       107.8870338549     -164.1054421184     -380.5425835760
C       106.4041575856     -164.2665707989     -380.9128427718
C       105.3981045428     -163.6100823484     -379.9716255001
C       104.2355867678     -164.1710686179     -379.5159307457
C       103.7221762217     -163.1905208792     -378.7309449478
C       103.4952428724     -165.2608785844     -379.9044970980
C       105.5572532607     -162.3359118948     -379.4613583983
N       104.5018792832     -162.1075152884     -378.7066494261
H       104.3238457019     -161.2803537680     -378.2159715006
C       102.4374052787     -163.1964040457     -378.2516897092
C       102.1964729620     -165.3089895155     -379.4189940343
C       101.6785163351     -164.2999425994     -378.6092399033
C       108.7068376910     -165.2690030614     -381.1008241164
O       108.3445254838     -165.8872254322     -382.1073614404
N       109.8361407532     -165.6087852558     -380.4667162442
H       110.1506864629     -165.0526513278     -379.7146225680
C       110.6114946584     -166.7768528792     -380.8752204501
C       112.0864956461     -166.6360774240     -380.4829334900
C       112.8157361432     -165.4707671422     -381.1433030690
C       114.3173506404     -165.4738424610     -380.8926675394
O       115.0474543669     -166.0402344288     -381.7046621541
O       114.7631989054     -164.9062816573     -379.8927181363
C       110.0015776711     -168.0619613926     -380.3104656365
O       110.5373639834     -168.7189907232     -379.4096197006
N       108.8203276534     -168.4108182911     -380.8317640253
H       108.4423481115     -167.8337416415     -381.5336232285
C       108.0607654921     -169.5691908875     -380.3791443306
C       107.5488656202     -169.3863562544     -378.9561286148
O       106.4313608514     -168.9223976983     -378.7242080137
N       108.4086122928     -169.7411853158     -377.9998403465
H       109.2868392056     -170.0735879012     -378.2871093611
C       108.1215577736     -169.5700070788     -376.5819525658
C       108.4570681942     -170.8552893783     -375.8239155829
C       107.7661288944     -171.0333159236     -374.4722280330
O       107.2891573448     -172.1237153166     -374.1721093056
N       107.6509263818     -170.0603027891     -373.5762735421
H       108.0029121134     -169.1641430744     -373.7749201504
H       107.1989138302     -170.2945568990     -372.7413825754
C       108.9417420344     -168.4112026258     -376.0174635042
O       108.5561965438     -167.7964082750     -375.0189819528
N       110.0813691430     -168.0763067145     -376.6326691691
H       110.3240094996     -168.5204119968     -377.4741110906
C       110.9462934059     -167.0101902791     -376.1511243435
C       112.3827426972     -167.3191126710     -376.5855179138
C       113.4481184960     -166.3636627819     -376.0687674422
C       114.7988087961     -166.7496578407     -376.6511849791
C       115.8409480565     -165.6650377935     -376.4112889276
N       115.5565122006     -164.4785161553     -377.2000498588
H       115.4834900361     -164.7161639669     -378.2212278639
H       114.6220197993     -164.0494850614     -376.9527513602
H       116.2927355622     -163.7614050125     -377.0691150841
C       110.4344930387     -165.6694976441     -376.6822719872
O       110.9208303723     -165.1012928735     -377.6689999141
N       109.3884616960     -165.1697464867     -376.0194895356
H       109.0203363067     -165.6979790427     -375.2756977498
C       108.7410604331     -163.9203602573     -376.4035765423
C       107.3251526941     -163.8444966180     -375.8106674758
C       106.3630051265     -164.9716088705     -376.1884665469
C       105.1988379158     -165.2869732938     -375.5427958429
C       104.7580423492     -166.3688111855     -376.2381139575
C       104.3830119465     -164.5870735543     -374.6873545175
C       106.5894119571     -165.8486098486     -377.2329201137
N       105.5821083747     -166.6959087616     -377.2380938901
H       105.5111457563     -167.4819984770     -377.8302369456
C       103.4802630404     -166.8586333535     -376.1430229587
C       103.0906647298     -165.0714072502     -374.5518179955
C       102.6485342988     -166.1846460832     -375.2625743125
C       109.5835126281     -162.7120126008     -375.9980663059
O       109.3354020222     -162.0212348110     -375.0041987483
N       110.5861678460     -162.4460722720     -376.8338761558
H       110.5642880182     -162.8641707963     -377.7248971121
C       111.6681524838     -161.5300481607     -376.5090813304
C       112.8869413777     -161.8862636188     -377.3915322826
O       113.1386680787     -163.2721692390     -377.1671450608
H       112.3786268318     -163.7996415980     -377.4654257965
C       114.1369768316     -161.0827562229     -377.0517381921
C       111.2633693407     -160.0651933245     -376.6556997433
O       110.9307548308     -159.5860577907     -377.7455905135
N       111.2731355743     -159.3416605710     -375.5323689126
H       111.4594526213     -159.7977595529     -374.6859734840
C       110.9617961108     -157.9177391145     -375.5082011882
C       110.5948149035     -157.4803136265     -374.0833910294
C       109.3045404149     -158.0943581299     -373.5532898892
C       109.1597103693     -159.2745633661     -372.8754442953
C       107.8213342178     -159.3240545810     -372.6564354515
C       110.0378463750     -160.1325064672     -372.2586080275
C       108.0828918675     -157.4721980784     -373.7226878818
N       107.1879243974     -158.2549942296     -373.1511500051
H       106.2274772715     -158.0699687369     -373.0913370263
C       107.2251125517     -160.2323550290     -371.8190936129
C       109.4648237984     -161.0735894109     -371.4154087065
C       108.0886362195     -161.1245887439     -371.2017857639
C       112.0815132108     -157.0483568823     -376.0818614718
O       112.8397144070     -156.3788416619     -375.3720676512
N       112.2034130329     -157.0726030064     -377.4110031636
H       111.6182862238     -157.6734662178     -377.9243898091
C       113.1808948940     -156.2627796576     -378.1208154430
C       113.4450780657     -156.8954276227     -379.4897250148
C       114.5416330994     -156.2531504210     -380.3327737483
C       114.6024531760     -156.8185829505     -381.7533599864
C       113.5034821350     -156.3134417995     -382.6957409228
N       112.2033334766     -156.9278976399     -382.4593830281
H       111.8152902540     -156.8197107851     -381.4808999500
H       112.3015556727     -157.9756438137     -382.5472233356
H       111.4622155614     -156.6729979735     -383.1730332059
C       112.6629992801     -154.8271407299     -378.2184142397
O       112.1199062520     -154.3582310291     -379.2199779684
N       112.8055550797     -154.0873003325     -377.1292898030
H       113.1885141529     -154.5302094710     -376.3372149216
H       112.5084679159     -153.1569355297     -377.1616132813
          147
Energy of minimum      8=     -424.3870209886 first found at step   202034
H       119.2890564213     -163.0777142340     -363.2213598666
H       120.2818195473     -162.1394917653     -362.2574192508
N       120.1761414856     -162.5003977524     -363.2225012453
H       120.9347944800     -163.1923876479     -363.4955221555
C       120.0115740388     -161.4750967782     -364.2495949207
C       121.3053237981     -160.6717243016     -364.3797101984
O       122.3477279103     -161.4587124192     -363.8220626656
H       121.9676894319     -161.7196400833     -362.9769656968
C       119.6380095029     -162.1030202775     -365.5903684323
O       119.9218685690     -163.2832687171     -365.8257459512
N       118.9925273662     -161.3428657569     -366.4791004839
H       118.7881919351     -160.4151809881     -366.2460081203
C       118.6015039472     -161.8339053089     -367.7941765396
C       117.5288634445     -160.9184608772     -368.4034152885
C       116.1062003340     -161.1178121670     -367.8795753411
C       114.9541540782     -160.9871424433     -368.6038542592
C       113.9932645825     -161.2975745303     -367.6974539164
C       114.6597426454     -160.4726447658     -369.8425096750
C       115.8151605946     -161.4916819325     -366.5812419023
N       114.5042404527     -161.5897462216     -366.4974305875
H       114.0103550608     -161.8350428000     -365.6789012351
C       112.6513433804     -161.1422314671     -367.9322609322
C       113.3085971121     -160.3175407816     -370.1183435335
C       112.3260420950     -160.6471758378     -369.1858741799
C       119.7968126576     -162.0003881870     -368.7311642217
O       120.1640089426     -161.1104377879     -369.5019512778
N       120.3900014637     -163.1920860899     -368.6661317510
H       119.9295951666     -163.9191773107     -368.1911055862
C       121.6354282379     -163.4693211233     -369.3647754148
C       122.4664811470     -164.4852268396     -368.5398587133
O       122.4740470705     -164.0014134356     -367.1980287297
H       121.5674555976     -163.7560837035     -366.9589535419
C       123.9013219453     -164.6099270203     -369.0342111412
C       121.3200911898     -163.9583989691     -370.7797467066
O       121.2213178048     -165.1568253037     -371.0622437182
N       121.1028193818     -162.9911249678     -371.6712019207
H       121.0889382752     -162.0633183684     -371.3527931538
C       120.8323511512     -163.2776751424     -373.0748944246
C       120.2159783803     -162.0502375098     -373.7659939220
C       118.7437297732     -161.7799964550     -373.4672161559
C       117.7411205024     -161.6315052746     -374.3872900117
C       116.6589705860     -161.3822993249     -373.6074727813
C       117.7261686086     -161.4311555605     -375.7461185844
C       118.2550760402     -161.6236762884     -372.1842536821
N       116.9678958060     -161.3723654632     -372.3090526748
H       116.3486248208     -161.2046346452     -371.5707933822
C       115.4629405217     -160.9204888702     -374.0938879956
C       116.5236213456     -160.9843321843     -376.2743799945
C       115.4154199953     -160.7354266898     -375.4668576597
C       122.0655713374     -163.7638927817     -373.8378490454
O       122.7394646292     -162.9982976698     -374.5352143554
N       122.4095146049     -165.0525177907     -373.7194482250
H       121.9075369503     -165.6281901413     -373.0945573336
C       123.5370613155     -165.6128029064     -374.4591608323
C       124.1123720850     -166.8378605945     -373.7399582502
C       124.7023841514     -166.5493985408     -372.3641545707
C       125.3805484591     -167.7540106145     -371.7267554200
O       126.5682657081     -167.9600396209     -371.9721140220
O       124.7275208012     -168.4837920519     -370.9771722226
C       123.1646366084     -165.9382574357     -375.9073351511
O       123.0798962595     -167.0973110072     -376.3312358540
N       122.9057702878     -164.8814258379     -376.6850882946
H       122.9752025575     -163.9875704230     -376.2792632191
C       122.4996392563     -164.9977337874     -378.0800694052
C       121.1233840135     -165.6348242985     -378.2221023289
O       120.0998050490     -164.9539619592     -378.3031837297
N       121.1194279763     -166.9687983515     -378.2293708538
H       121.9857324346     -167.4204081485     -378.1300599649
C       119.8929626049     -167.7521260961     -378.2859659754
C       120.0275671251     -168.8569330778     -379.3349611542
C       118.7174308930     -169.4320173355     -379.8728655020
O       118.5994733676     -169.6541471708     -381.0742273322
N       117.6734837113     -169.7197989147     -379.1045021915
H       117.7109383330     -169.5475529441     -378.1373587903
H       116.8934086339     -170.0936975929     -379.5605030299
C       119.6047802607     -168.3725599151     -376.9201114857
O       118.4481205167     -168.6527469495     -376.5926724991
N       120.6279626912     -168.5992202464     -376.0887836104
H       121.5266926682     -168.2888402144     -376.3338897423
C       120.4485616088     -169.2055627622     -374.7777869056
C       121.7439920919     -169.9199108128     -374.3774609308
C       121.6828644526     -170.6879602360     -373.0639613273
C       123.0513264822     -171.2670520422     -372.7427204689
C       123.1112990431     -171.7946310934     -371.3146616432
N       123.0694879918     -170.7111899039     -370.3470724983
H       123.8380817481     -170.0180684212     -370.5298166502
H       122.1717569984     -170.1546257903     -370.4038623608
H       123.1647488527     -171.0761721924     -369.3819933600
C       120.0341395873     -168.1234352550     -373.7793879828
O       120.8275500434     -167.5720364215     -373.0051323146
N       118.7433940112     -167.7852531853     -373.8325115451
H       118.1794029620     -168.2279007405     -374.5061207750
C       118.1752885186     -166.7472972748     -372.9833206637
C       116.8464052499     -166.2360558647     -373.5586144775
C       116.9102842089     -165.6149879860     -374.9539811419
C       115.8496712240     -165.4055367167     -375.7923491603
C       116.4456411303     -164.8943095135     -376.9021274505
C       114.4947876014     -165.3152428240     -375.5841451718
C       118.0909430069     -165.2327300784     -375.5632411161
N       117.7706565836     -164.7916027069     -376.7613337554
H       118.4197967234     -164.5190335095     -377.4526580234
C       115.7574530396     -164.2596613824     -377.9047773983
C       113.7675513958     -164.6988538657     -376.5912711616
C       114.3847141676     -164.1836159645     -377.7286341547
C       118.0187839199     -167.2124367912     -371.5387783064
O       116.9449823927     -167.5917312302     -371.0596211731
N       119.1371227529     -167.1114291999     -370.8220248127
H       119.8691327020     -166.5642261148     -371.1879943001
C       119.2481423895     -167.6494899598     -369.4774838072
C       120.7223212020     -168.0437109258     -369.2201658717
O       121.1319004360     -168.8229188881     -370.3447761026
H       121.0739574680     -168.2804234368     -371.1495058638
C       120.8960567927     -168.8635065286     -367.9483311448
C       118.7210288046     -166.5903181978     -368.5083354178
O       119.4574849092     -165.8005024552     -367.9067635921
N       117.3891059294     -166.5320252531     -368.4186104652
H       116.8573561544     -167.1263321236     -368.9870883147
C       116.7249013685     -165.5531654611     -367.5713771072
C       115.2858298948     -165.3080586218     -368.0536728274
C       115.1254969662     -164.7313885038     -369.4627159856
C       113.9577588350     -164.6697646211     -370.1739999971
C       114.3524743282     -164.0884383993     -371.3350014959
C       112.6334296284     -164.8328058648     -369.8465158053
C       116.1720812531     -164.1981614675     -370.1897195905
N       115.6593254257     -163.8039030851     -371.3395169295
H       116.1555882256     -163.3654105071     -372.0618175590
C       113.4775559899     -163.6263604990     -372.2850716242
C       111.7220819344     -164.3883615228     -370.7935594594
C       112.1343371066     -163.8002511253     -371.9878373915
C       116.7666598111     -165.9460491251     -366.0970901819
O       115.8343889409     -166.5402697474     -365.5450939602
N       117.8890500378     -165.6395453061     -365.4425975035
H       118.6266871210     -165.2267232042     -365.9450368281
C       118.0551556491     -165.9335570425     -364.0245578650
C       119.5247991068     -165.9225248295     -363.5889547444
C       120.5547330996     -166.5618960213     -364.5141959585
C       121.9796592317     -166.4194579613     -363.9663645255
C       122.3799866143     -165.0001722164     -363.5385775682
N       122.1708623739     -164.0180753126     -364.5925524610
H       121.1848764639     -163.9873713393     -364.9634864604
H       122.7293254821     -164.2975642240     -365.4441686412
H       122.5185791253     -163.0405958628     -364.3784043719
C       117.2915636076     -164.8764932687     -363.2323523453
O       117.8315362782     -163.8719019468     -362.7663244079
N       115.9897157382     -165.0653105596     -363.0793224011
H       115.5984241551     -165.8514946875     -363.5254324645
H       115.4874390012     -164.4116564510     -362.5545951937
          147
Energy of minimum      9=     -424.2856427810 first found at step   202051
H        60.0666439632     -137.6675537888     -377.9019813318
H        58.7658516521     -138.5491015675     -378.4728004040
N        59.4978503795     -137.8789168508     -378.7691693444
H        59.1072407556     -136.9342501188     -379.0589514797
C        60.4471407725     -138.3591227972     -379.7692953705
C        59.7069652727     -138.6456181370     -381.0744253915
O        58.5277665009     -137.8562206319     -381.0656560381
H        58.1619799378     -138.0631684766     -380.1984979840
C        61.5331955132     -137.3059457897     -379.9794744342
O        61.4087429344     -136.1931272480     -379.4549638300
N        62.5971049858     -137.6188691841     -380.7241235641
H        62.6515671606     -138.5131965367     -381.1164200167
C        63.6592705442     -136.6600866184     -380.9859811731
C        64.9944941109     -137.3961768635     -381.1877307682
C        65.6919382464     -137.8941894329     -379.9205788461
C        67.0411504074     -138.0217662838     -379.7410912554
C        67.1328457003     -138.4661273224     -378.4622740184
C        68.1237927523     -137.9764583447     -380.5845875119
C        65.0195176508     -138.2615500189     -378.7703400917
N        65.9339432734     -138.6143537486     -377.8902788046
H        65.7408434500     -138.9318455444     -376.9759512319
C        68.3032127748     -138.8950609618     -377.8910690127
C        69.3280782807     -138.3892698284     -380.0323023859
C        69.4170342352     -138.8360057391     -378.7146959988
C        63.3370513034     -135.7338012366     -382.1594888998
O        63.7842923954     -135.9447725358     -383.2892782726
N        62.5958816598     -134.6668835792     -381.8618307982
H        62.4473560835     -134.4491627111     -380.9148232820
C        62.1576546499     -133.7335328186     -382.8896665799
C        60.8261768676     -133.0610519532     -382.4631249138
O        59.9286754707     -134.1233195276     -382.1480654995
H        59.8632153707     -134.7067365324     -382.9124476130
C        60.2055351808     -132.2109113332     -383.5648170805
C        63.2713726791     -132.7258897163     -383.1960917005
O        63.3515736367     -131.6292338525     -382.6333305209
N        64.1710255735     -133.1419565652     -384.0877370772
H        64.1081450452     -134.0658332770     -384.4116194234
C        65.2593225034     -132.2877324125     -384.5488426291
C        66.3558966741     -133.1257314536     -385.2279851004
C        67.2858421890     -133.9078636087     -384.3038577249
C        68.6538701324     -133.9206880773     -384.3501822321
C        68.9751666321     -134.7845781978     -383.3543261287
C        69.5728482082     -133.5023703172     -385.2814545901
C        66.8241296792     -134.7417908222     -383.3035587019
N        67.8926900085     -135.2713256677     -382.7437939789
H        67.8871487591     -135.9146294034     -382.0070534807
C        70.2299662260     -135.3094562479     -383.1801492553
C        70.8587355038     -133.9980697014     -385.1214322478
C        71.1813859153     -134.8812870275     -384.0928505223
C        64.7858857170     -131.1729911991     -385.4830470369
O        64.8335353923     -131.2967870855     -386.7114567840
N        64.2996717028     -130.0531562735     -384.9331053936
H        64.1942195194     -130.0059047856     -383.9530462215
C        63.8869526647     -128.9176201777     -385.7535939216
C        62.8390321711     -128.0658671166     -385.0289752351
C        61.5210195061     -128.7791781941     -384.7524783435
C        60.4560992591     -127.8799985952     -384.1404615432
O        59.7390851180     -127.2197237938     -384.8910285621
O        60.3335065203     -127.8449629651     -382.9139339501
C        65.0814681534     -128.0719284858     -386.2002411476
O        65.2848749889     -126.9276984192     -385.7764002245
N        65.9149305864     -128.6638560500     -387.0626603506
H        65.7028444504     -129.5821750696     -387.3458598986
C        67.1231917685     -128.0257754107     -387.5706563842
C        68.1609351691     -127.8125705804     -386.4760473119
O        69.0620968079     -128.6271298504     -386.2704688316
N        68.0009024227     -126.6992620786     -385.7587684569
H        67.2337694449     -126.1283197892     -385.9819933937
C        68.8504785869     -126.3645774882     -384.6243073442
C        69.2852876993     -124.9008677451     -384.7108622706
C        70.5342449652     -124.5252697679     -383.9135112925
O        71.3710468862     -123.7785017367     -384.4121083045
N        70.7771700221     -124.9606018816     -382.6827834290
H        70.1460485253     -125.5721695710     -382.2421754200
H        71.6048330400     -124.6432793133     -382.2697982300
C        68.0932782968     -126.5993171611     -383.3186242847
O        68.7062707749     -126.8615320389     -382.2798430723
N        66.7579289065     -126.5208550465     -383.3269267254
H        66.2870887538     -126.3980770168     -384.1797827846
C        65.9586764826     -126.7121272193     -382.1256398530
C        64.6420408577     -125.9416303391     -382.2713101227
C        63.7348939606     -125.9731799336     -381.0484604426
C        62.4354050699     -125.2446980591     -381.3509218933
C        61.3931430582     -125.4963704138     -380.2685714498
N        60.9135932999     -126.8677352002     -380.3035976269
H        60.1694431713     -127.0150091189     -379.5977595697
H        61.6843081028     -127.5697404859     -380.1233014709
H        60.5361637697     -127.1056637959     -381.2551424761
C        65.7484481353     -128.2097546971     -381.8973743103
O        64.7219920462     -128.8137645802     -382.2358600905
N        66.7857318007     -128.8336689120     -381.3334709342
H        67.5897816081     -128.3024432424     -381.1357960714
C        66.7810499130     -130.2651446332     -381.0668345615
C        68.2107295388     -130.7909921215     -380.8716522060
C        69.1605528516     -130.6259322122     -382.0581738800
C        70.5229760677     -130.7448376605     -382.0221857334
C        70.8796405175     -130.4546915620     -383.3015398469
C        71.3873992933     -131.3504660010     -381.1428687719
C        68.7390954005     -130.2770960968     -383.3278041424
N        69.8214919668     -130.1811237518     -384.0706430923
H        69.8350609003     -129.8736477059     -385.0081293574
C        72.1198299472     -130.7274238096     -383.8204187499
C        72.6575194025     -131.6185666665     -381.6307494412
C        73.0175213219     -131.3120072151     -382.9408542005
C        65.8887609856     -130.6153449502     -379.8803367527
O        66.3232266574     -130.8135644047     -378.7408394172
N        64.6016082005     -130.7449968690     -380.1982171348
H        64.3706218458     -130.8325006918     -381.1512081276
C        63.5692759991     -130.9126324465     -379.1910871797
C        62.2485859420     -130.3063668217     -379.7230939251
O        62.5737054758     -129.0047479838     -380.2135963481
H        63.2171022092     -129.0874829223     -380.9377358919
C        61.1835958740     -130.1839535394     -378.6415603068
C        63.4722967917     -132.4044777503     -378.8705409770
O        62.6496320669     -133.1570760025     -379.4042860324
N        64.3998473913     -132.8517970363     -378.0190584338
H        65.0791166844     -132.2236756879     -377.6978383470
C        64.4660282633     -134.2505504795     -377.6215171719
C        65.8825614547     -134.6152903480     -377.1452328496
C        67.0141852341     -134.4811169227     -378.1679678960
C        68.3521719682     -134.5771387618     -377.8961111386
C        68.9138999267     -134.3718792972     -379.1143045673
C        69.0751092059     -135.0337028179     -376.8206636951
C        66.8025042973     -134.2285836932     -379.5094678521
N        67.9967175257     -134.1734958563     -380.0673318381
H        68.1719403062     -134.0263247183     -381.0201740812
C        70.2425115919     -134.5857344606     -379.3801773671
C        70.4263205841     -135.2465378806     -377.0528406162
C        70.9986102049     -135.0252832341     -378.3041035450
C        63.4197992933     -134.5748650446     -376.5587061491
O        63.6698947683     -134.5317117645     -375.3493604583
N        62.1972866570     -134.8600191087     -377.0128152680
H        62.0350496828     -134.8154971932     -377.9816665427
C        61.1002078512     -135.1940837784     -376.1137951212
C        59.7312067355     -134.9873964452     -376.7714486274
C        59.5517550342     -133.7379210181     -377.6287458062
C        58.2019998779     -133.7220439183     -378.3516920920
C        57.8672595006     -135.0061905512     -379.1215705177
N        58.9094625103     -135.3951379814     -380.0627299792
H        59.8786216846     -135.4966833809     -379.6526720366
H        58.6752550985     -136.2254073725     -380.6734647971
H        59.0619525342     -134.6172600631     -380.7625824941
C        61.2588949039     -136.6579941744     -375.7164147995
O        60.6607092230     -137.5759228457     -376.2799190967
N        62.1067406146     -136.9193347052     -374.7331870609
H        62.6051666825     -136.1559009718     -374.3604282057
H        62.2073331076     -137.8477827348     -374.4455246492
          147
Energy of minimum     10=     -424.1025345618 first found at step   205379
H       111.2180468237     -170.9771393574     -368.9771235377
H       112.5648033403     -169.9987469927     -368.8221499858
N       111.8251833733     -170.2788701101     -369.4909530838
H       112.1985809498     -170.8238043466     -370.3231584230
C       111.0863247960     -169.0934921243     -369.8871011095
C       110.6943685076     -168.3651111093     -368.6043005759
O       111.7127603298     -168.5313192156     -367.6181182126
H       111.3570610455     -168.2220647870     -366.7783314924
C       111.9328787999     -168.2096878910     -370.7988919328
O       113.1609938604     -168.3522162389     -370.8184876782
N       111.3151112963     -167.3137373529     -371.5734645170
H       110.3410757466     -167.2395750599     -371.5240808048
C       112.0491106511     -166.4431372937     -372.4824470175
C       111.0781762634     -165.8060217767     -373.4885340104
C       111.7116303667     -165.1836948631     -374.7339023467
C       111.1428754618     -164.2570764603     -375.5626129700
C       112.1090215902     -164.0542355478     -376.4935563130
C       109.8758129858     -163.7438060009     -375.6920707184
C       112.9778839232     -165.5114605139     -375.1803595770
N       113.1932801129     -164.8031465422     -376.2698770660
H       114.0186258734     -164.8397953407     -376.8098258909
C       111.9203623211     -163.3152650464     -377.6330073180
C       109.6558683990     -162.9770134423     -376.8275835393
C       110.6557690980     -162.7648901806     -377.7756210075
C       112.8417291829     -165.4018906199     -371.6911259986
O       112.3369435176     -164.3726477299     -371.2363645053
N       114.1289799245     -165.7083548482     -371.5320308111
H       114.5118818799     -166.4245328547     -372.0858905538
C       115.0014492744     -164.9660490770     -370.6390889015
C       116.0275558478     -165.9470955413     -370.0226364626
O       115.2567850793     -166.9941681118     -369.4359516070
H       114.5861761971     -167.2886874543     -370.0747506646
C       116.9024879886     -165.3063807720     -368.9519939252
C       115.6546044781     -163.8047751141     -371.3841653937
O       116.6405947292     -163.9538695483     -372.1131238952
N       115.0512216443     -162.6264591808     -371.2259909701
H       114.2094924041     -162.6017440379     -370.7227187161
C       115.5591813073     -161.3990481964     -371.8226991463
C       114.4734536973     -160.3117838532     -371.7925228782
C       113.4046658872     -160.3956525907     -372.8785946039
C       112.9224055934     -159.3492881011     -373.6177544274
C       112.0080215618     -159.9507724667     -374.4198674869
C       112.9928111591     -157.9841198142     -373.4830797757
C       112.7873942997     -161.5764210962     -373.2446174147
N       111.9271631282     -161.2633950901     -374.1920254186
H       111.3303041492     -161.8912474680     -374.6461374249
C       111.0853767357     -159.2644632754     -375.1669034904
C       112.0867878256     -157.2579300146     -374.2424224260
C       111.1540271878     -157.8835378348     -375.0674854219
C       116.8514935233     -160.8821529713     -371.1898794120
O       116.8379038258     -159.9898249900     -370.3353897902
N       118.0105525182     -161.4212138025     -371.5884591479
H       117.9952990887     -162.1873219511     -372.2103228665
C       119.2899050595     -160.9034777012     -371.1113213012
C       120.3835940810     -161.9760667409     -371.1635429712
C       120.1325989208     -163.1896526644     -370.2747403922
C       121.3197894977     -164.1392809707     -370.1943796204
O       121.4283585541     -165.0412169350     -371.0283649276
O       122.1376742789     -163.9821930164     -369.2890774453
C       119.6966831442     -159.6501230932     -371.8898227000
O       120.6313604001     -159.6379250927     -372.7000742351
N       118.9436262762     -158.5680398256     -371.6644210454
H       118.2048349154     -158.6517893287     -371.0196996476
C       119.1422135591     -157.3011285893     -372.3566019109
C       118.8083471685     -157.4105437757     -373.8388263050
O       117.6864654546     -157.1424669977     -374.2716979674
N       119.8091575352     -157.8383806100     -374.6101171121
H       120.6577369504     -158.0536614646     -374.1652973671
C       119.6548121966     -158.0730315271     -376.0395314142
C       120.8117491357     -157.4248579631     -376.8014456627
C       120.5574764172     -157.1328848745     -378.2800403633
O       120.9109293124     -156.0586911878     -378.7572449887
N       119.9686507210     -157.9914176519     -379.1040310407
H       119.6532764970     -158.8594859484     -378.7672057060
H       119.8700843339     -157.6995386507     -380.0321062744
C       119.6283463270     -159.5738127594     -376.3244234817
O       119.0689339518     -160.0118666849     -377.3337546365
N       120.2193150024     -160.3995847725     -375.4536538019
H       120.5810626360     -160.0383373415     -374.6153416316
C       120.2752100981     -161.8393469910     -375.6551238837
C       121.5202502638     -162.3794840590     -374.9440098276
C       121.8037909665     -163.8608516543     -375.1443608464
C       123.0125917184     -164.2612320545     -374.3130654329
C       123.1629712338     -165.7751558613     -374.2393483002
N       122.1024576123     -166.3711357352     -373.4449866716
H       122.0692196369     -165.9453139401     -372.4846848559
H       121.1453428558     -166.1896621360     -373.8566904857
H       122.2348460742     -167.3950996577     -373.3590218143
C       118.9754066049     -162.4683646833     -375.1488021803
O       118.8717792199     -163.0106590562     -374.0405644606
N       117.9389465149     -162.3549032779     -375.9831224776
H       118.0785543438     -161.8677370670     -376.8263015175
C       116.6102148202     -162.8598864121     -375.6559693431
C       115.5465625381     -162.1813874779     -376.5336165773
C       115.4679125482     -160.6559528904     -376.4584795687
C       114.8522144359     -159.8357397721     -377.3639059585
C       115.1062550665     -158.5977538365     -376.8629115303
C       113.8926994118     -160.0523632097     -378.3228724457
C       116.0622950866     -159.9107570407     -375.4571471737
N       115.8199587696     -158.6469612671     -375.7340877366
H       116.1852382145     -157.8806854460     -375.2310982485
C       114.4441655068     -157.4674931952     -377.2701415808
C       113.2210174070     -158.9254088233     -378.7722361086
C       113.4918262040     -157.6593053135     -378.2588171202
C       116.5497749345     -164.3816363181     -375.7782892312
O       116.0483692764     -164.9598101538     -376.7482443494
N       117.0502494357     -165.0294601890     -374.7273518612
H       117.1857019274     -164.5200361554     -373.8958813422
C       117.3477587025     -166.4530649206     -374.7406763836
C       118.4002244314     -166.7391060921     -373.6444749301
O       119.4905172551     -165.8592309657     -373.9120121295
H       119.2000928511     -164.9356263589     -373.8254854544
C       118.8997431305     -168.1793040737     -373.6445763639
C       116.1002789414     -167.3181459799     -374.5769212331
O       115.4100036967     -167.2813447833     -373.5521134847
N       115.7927446410     -168.1005649542     -375.6155310649
H       116.3260260942     -168.0206919798     -376.4330619479
C       114.6649119645     -169.0237831786     -375.6001689772
C       114.2817583735     -169.4160207466     -377.0337930451
C       113.7388242076     -168.2656657065     -377.8733034285
C       114.4501609047     -167.3945604768     -378.6533743053
C       113.4783521792     -166.5930397956     -379.1581686947
C       115.7387311502     -167.3770473695     -379.1297735121
C       112.3882611855     -167.9800220153     -377.9242071462
N       112.2603745642     -166.9449988132     -378.7321453335
H       111.4127988016     -166.5219589303     -378.9829904874
C       113.6912463193     -165.6917927779     -380.1701278005
C       115.9907484928     -166.4654835515     -380.1449167236
C       114.9901492239     -165.6390011722     -380.6527118846
C       114.9163191547     -170.2612412242     -374.7377002388
O       115.1829060055     -171.3682271272     -375.2177425429
N       114.8484337892     -170.0660967661     -373.4188464578
H       114.6994216311     -169.1523746398     -373.0873602864
C       115.0087366989     -171.1479874040     -372.4598541620
C       115.4175652829     -170.5530438444     -371.1093321668
C       115.7534627399     -171.5447491744     -370.0005001011
C       115.9972586995     -170.8631028259     -368.6519817636
C       114.7331595468     -170.3961305879     -367.9201149332
N       114.1422103999     -169.1898812548     -368.4841196798
H       113.3339435576     -168.8020879480     -367.9220597723
H       113.8527791376     -169.2598538566     -369.5004526556
H       114.8631710702     -168.4188388516     -368.4908639271
C       113.7104535855     -171.9534896846     -372.3899568166
O       112.8607368932     -171.8147901351     -371.5086508395
N       113.5186180497     -172.8233531842     -373.3699642795
H       114.1987627170     -172.8489681218     -374.0819726230
H       112.7117154207     -173.3740253624     -373.3464577759
