PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

cis-pt(pet3)2(set)2   7706 cis-Pt(PEt3)2(SEt)2

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    #  Species Formula
  7696 Platinum(IV) oxide difluoride (Geo)OF2Pt
  7697 cis-Pt(PEt3)2(CH3)2C14H36P2Pt
  7698 cis-Pt(PEt3)2(2-Tol)2C26H44P2Pt
  7699 trans-Pt(PPh3)(C2H5)(benzoyl) (Geo)C45H40OP2Pt
  7700 Oxalato-bis(trimethylphosphine) platinum (Geo)C8H18O4P2Pt
  7701 Pt(PMe3)2F2 (cis) (Geo)C6H18F2P2Pt
  7702 cis-Pt(SMe2)2(C6H5)2 (Geo)C16H22S2Pt
  7703 Platinum(cyclooctadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7704 Platinum(cyclooctadiene) maleonitriledithiolatoC12H12N2S2Pt
  7705 Pt(Cyclo-octadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7706 cis-Pt(PEt3)2(SEt)2 C16H40P2S2Pt
  7707 Pt(III)S4(-) (BEKSIT) (Geo)C8N4S4Pt
  7708 Pt(III)S4(-) (BEKSIT)C8N4S4Pt
  7709 Methyl platinum(II) chlorideCH3ClPt
  7710 Methyl platinum(II) chloride (Geo)CH3ClPt
  7711 Pt(II)N2ClO (ACHGLP10) (Geo)C2H7N2O2ClPt
  7712 Pt(II)N2ClO (ACHGLP10)C2H7N2O2ClPt
  7713 cis-Pt(PEt3)2Cl(CH3)C13H33P2ClPt
  7714 cis-Pt(PEt3)2Cl(2-Tol)C19H37P2ClPt
  7715 Pt(II)C4Cl2 (BOFTEV) (Geo)C4H8Cl2Pt
  7716 Pt(II)C4Cl2 (BOFTEV)C4H8Cl2Pt


ΔHf: -108.7 kcal/mol,     REF: D. Takhin and H. A. Skinner, J. Chem. Soc., Dalton Trans., 2323 (1983).
  
 UHF SHIFT=10 TRIPLET PM7
cis-Pt(PEt3)2(SEt)2
 H=-108.7 HR=TS1983
 Pt     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.22013534 +1    0.0000000 +0    0.0000000 +0     1     0     0
  S     2.38270008 +1   88.3283975 +1    0.0000000 +0     1     2     0
  P     2.38608421 +1   88.6619197 +1  176.1964480 +1     1     2     3
  P     2.42440827 +1   83.3236895 +1  178.3395964 +1     1     3     2
  C     1.88330965 +1  112.4424970 +1  -91.7501095 +1     4     1     2
  C     1.89307616 +1  120.9140225 +1  146.6801885 +1     4     1     2
  C     1.87394105 +1  112.7394250 +1   25.6166281 +1     4     1     2
  C     1.88530201 +1  112.4766221 +1  -63.6101958 +1     5     1     3
  C     1.89977911 +1  121.2595625 +1  173.8240328 +1     5     1     3
  C     1.88544632 +1  112.4980037 +1   51.9795451 +1     5     1     3
  C     1.54045617 +1  117.5238992 +1  -57.2211450 +1     6     4     1
  H     1.13128359 +1  107.5690759 +1   64.2497799 +1     6     4     1
  H     1.12199766 +1  109.9690292 +1  178.0369233 +1     6     4     1
  H     1.12034382 +1  110.1831100 +1   69.9785349 +1     7     4     1
  C     1.54033658 +1  116.6810852 +1  -55.3946384 +1     7     4     1
  H     1.12580874 +1  108.3769793 +1 -177.1185848 +1     7     4     1
  C     1.53921779 +1  119.3901966 +1  179.3321702 +1     8     4     1
  H     1.13271241 +1  108.0249249 +1   55.0164812 +1     8     4     1
  H     1.13537929 +1  108.9996068 +1  -56.3831209 +1     8     4     1
  H     1.13347569 +1  108.0504416 +1   62.3524665 +1     9     5     1
  H     1.12039392 +1  110.4271467 +1  176.6191502 +1     9     5     1
  C     1.54137721 +1  116.3060203 +1  -58.8341523 +1     9     5     1
  H     1.12592553 +1  108.3542606 +1   62.2635009 +1    10     5     1
  C     1.54178525 +1  118.3601385 +1 -175.6528849 +1    10     5     1
  H     1.12505359 +1  108.5551368 +1  -53.3167778 +1    10     5     1
  C     1.54182675 +1  116.2452102 +1   58.4612916 +1    11     5     1
  H     1.12092905 +1  110.1185471 +1 -177.4000509 +1    11     5     1
  H     1.13282247 +1  108.7964710 +1  -63.1289979 +1    11     5     1
  H     1.09966126 +1  109.3659997 +1 -177.9172178 +1    25    10     5
  H     1.09826895 +1  113.3581540 +1   63.7614107 +1    25    10     5
  H     1.09792292 +1  113.6139644 +1  -59.4914344 +1    25    10     5
  H     1.09627904 +1  113.4941904 +1  -68.5190824 +1    23     9     5
  H     1.09948244 +1  109.2508930 +1  172.8314959 +1    23     9     5
  H     1.10464274 +1  113.0748678 +1   55.0207475 +1    23     9     5
  H     1.10425128 +1  112.8009377 +1  -59.9004800 +1    27    11     5
  H     1.09951451 +1  109.1462730 +1 -177.4075622 +1    27    11     5
  H     1.09597014 +1  113.7776028 +1   63.7646936 +1    27    11     5
  H     1.10157997 +1  108.9757440 +1  178.0781477 +1    18     8     4
  H     1.09689520 +1  113.7728066 +1   59.9788419 +1    18     8     4
  H     1.09704630 +1  113.6407086 +1  -63.8724429 +1    18     8     4
  H     1.09995327 +1  109.2838782 +1  178.2702241 +1    12     6     4
  H     1.10300115 +1  112.9531420 +1   60.5852693 +1    12     6     4
  H     1.09608383 +1  113.8771098 +1  -63.1938073 +1    12     6     4
  H     1.09817700 +1  109.5851424 +1  173.6301102 +1    16     7     4
  H     1.10003540 +1  114.5453803 +1   53.9033779 +1    16     7     4
  H     1.10035113 +1  112.6593521 +1  -68.1270644 +1    16     7     4
  C     1.81957896 +1  117.3572750 +1  -67.9645419 +1     2     1     3
  C     1.52410694 +1  111.3113664 +1 -136.3835908 +1    48     2     1
  H     1.09592544 +1  110.8945079 +1 -176.3990099 +1    49    48     2
  H     1.09480237 +1  112.1278620 +1   63.3546114 +1    49    48     2
  H     1.09827260 +1  111.6301980 +1  -56.8552688 +1    49    48     2
  H     1.10308525 +1  109.4532009 +1  -12.8837845 +1    48     2     1
  H     1.10700400 +1  105.7045606 +1  102.7764974 +1    48     2     1
  C     1.83507650 +1  106.3871607 +1  -69.4064808 +1     3     1     2
  C     1.52125208 +1  111.6646405 +1 -127.9980955 +1    55     3     1
  H     1.09720189 +1  110.7730916 +1 -174.2503257 +1    56    55     3
  H     1.09540098 +1  112.2807557 +1   66.0117866 +1    56    55     3
  H     1.09758397 +1  111.9934513 +1  -54.9645081 +1    56    55     3
  H     1.10533967 +1  109.4407235 +1   -4.4630764 +1    55     3     1
  H     1.10523257 +1  107.3457158 +1  110.4756814 +1    55     3     1