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

sis3c (msisul10)   2314 SiS3C (MSISUL10)

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    #  Species Formula
  2304 Sulfur tetramerS4
  2305 Sulfur, tetramer (open chain)S4
  2306 Hydrogen tetrasulfideH2S4
  2307 SiS4 (DANCUQ) (Geo)C4H8SiS4
  2308 SiS4 (DANCUQ)C4H8SiS4
  2309 Sulfur, pentamerS5
  2310 Hydrogen pentasulfideH2S5
  2311 S6 (Geo)S6
  2312 Sulfur, hexamerS6
  2313 SiS3C (MSISUL10) (Geo)C4H12Si4S6
  2314 SiS3C (MSISUL10) C4H12Si4S6
  2315 S8S8
  2316 S8 (Geo)S8
  2317 Chlorine, cation 3P(u)Cl
  2318 Chlorine, cationCl
  2319 Chlorine, atomCl
  2320 Chloride, anionCl
  2321 Hydrogen chloride (Geo)HCl
  2322 Hydrogen chlorideHCl
  2323 Helium chloride anion (Geo)HeCl
  2324 Lithium chloride (Geo)LiCl


ΔHf: -227.0 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 PM7
SiS3C (MSISUL10)
 H=-227.0 HR=PW91D
 Si     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.85131653 +1    0.0000000 +0    0.0000000 +0     1     0     0
  S     2.13685561 +1  107.4473038 +1    0.0000000 +0     1     2     0
  H     5.31174343 +1  124.7978570 +1 -108.2532668 +1     1     2     3
  H     1.11119813 +1  111.8953795 +1  179.7795683 +1     2     1     3
  H     1.11118127 +1  111.9086693 +1  119.9896953 +1     2     1     5
  H     1.11118829 +1  111.9230342 +1  120.0145353 +1     2     1     6
 Si     2.48699734 +1   30.1691734 +1 -161.3128054 +1     4     1     2
  S     2.13678591 +1  132.0176225 +1  139.7879035 +1     8     4     1
  S     2.13653123 +1  107.4659254 +1  -11.7673104 +1     1     2     4
  S     2.13688016 +1   94.5277419 +1  124.3840058 +1     8     4     9
 Si     2.13699320 +1  105.4147813 +1 -179.5633498 +1     9     8     4
  S     2.13687913 +1  107.4346668 +1 -119.9694194 +1     1     2    10
 Si     2.13685276 +1  105.4140187 +1  179.9463910 +1     3     1     2
  C     1.85115252 +1  107.4463790 +1  179.9876296 +1    12     9     8
  S     2.13681338 +1  111.4448662 +1  -62.5203133 +1    14     3     1
  C     1.85118785 +1  107.4657160 +1 -117.4692805 +1    14     3    16
  H     1.11118340 +1  111.9138420 +1  -60.0349838 +1    15    12     9
  H     1.11117485 +1  111.9080966 +1  120.0010131 +1    15    12    18
  H     1.11120792 +1  111.9120040 +1  119.9966850 +1    15    12    19
  H     1.11119334 +1  111.9023768 +1 -179.7053149 +1    17    14     3
  H     1.11121921 +1  111.9126868 +1  119.9938428 +1    17    14    21
  H     1.11117773 +1  111.9126181 +1  120.0113408 +1    17    14    22
  C     1.11096018 +1   69.2124943 +1   27.8440641 +1     4     1     8
  H     1.11111478 +1  107.0097093 +1 -142.6349621 +1    24     4     1
  H     1.11106313 +1  107.0135870 +1 -114.3593124 +1    24     4    25