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

1,3-dichloro-1,1,3,3-tetranitropropane   2518 1,3-Dichloro-1,1,3,3-tetranitropropane

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    #  Species Formula
  2508 Be(II)Cl2 (ETBECL)H10BeC4OCl2
  2509 Cl2O2O2Cl2
  2510 Oxalyl chlorideC2O2Cl2
  2511 Oxalyl chloride (Geo)C2O2Cl2
  2512 Be(II)Cl2O2 (ETBECL01) (Geo)H20BeC8O2Cl2
  2513 Be(II)Cl2O2 (ETBECL01)H20BeC8O2Cl2
  2514 1,1-Dichloro-1-nitro-propaneC3H5NO2Cl2
  2515 B3O3HCl2HB3O3Cl2
  2516 Chlorine heptoxideO7Cl2
  2517 1,1',2,2'-Tetranitro-1,2-dichloroethaneC2N4O8Cl2
  2518 1,3-Dichloro-1,1,3,3-tetranitropropane C3H2N4O8Cl2
  2519 DichlorofluorboraneBFCl2
  2520 FluorodichloromethaneHCFCl2
  2521 Dichlorodifluoromethane (Geo)CF2Cl2
  2522 DifluorodichloromethaneCF2Cl2
  2523 1,2-Dichloro 1,1,2,2-tetrafluoroethaneC2F4Cl2
  2524 Sodium chloride, dimer (Geo)Na2Cl2
  2525 Sodium chloride, dimerNa2Cl2
  2526 Magnesium dichlorideMgCl2
  2527 Magnesium dichloride (Geo)MgCl2
  2528 Mg(II)O4Cl2 (CEXWUX10) (Geo)C8H20O6MgCl2


ΔHf: -17.6 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
1,3-Dichloro-1,1,3,3-tetranitropropane
 H=-17.6 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52094650 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.52306298 +1  117.3027135 +1    0.0000000 +0     2     1     0
 Cl     1.76577450 +1  108.4161807 +1 -162.6494288 +1     1     2     3
 Cl     1.74858900 +1  112.4688423 +1  -27.6680709 +1     3     2     1
  N     1.53841522 +1  112.6319257 +1 -116.6020509 +1     1     2     4
  N     1.53387076 +1  112.8442036 +1 -126.4329355 +1     1     2     6
  N     1.54156566 +1  111.5358548 +1 -119.5182234 +1     3     2     5
  N     1.54805470 +1  110.6415992 +1 -117.4836537 +1     3     2     8
  O     1.20248421 +1  117.9583985 +1 -126.0512372 +1     9     3     2
  O     1.21236196 +1  114.1249038 +1 -179.8651382 +1     9     3    10
  O     1.20996313 +1  116.7909269 +1   10.6367510 +1     8     3     2
  O     1.20791488 +1  116.0848282 +1  179.4798124 +1     8     3    12
  O     1.21375702 +1  114.2606981 +1  -37.5649701 +1     7     1     2
  O     1.20376810 +1  118.3385045 +1 -179.6684358 +1     7     1    14
  O     1.20524253 +1  117.2262557 +1 -178.1065940 +1     6     1     2
  O     1.21281971 +1  115.5751396 +1 -177.6169000 +1     6     1    16
  H     1.13480051 +1  108.2872870 +1 -124.5046345 +1     2     1     3
  H     1.12982557 +1  109.8309022 +1 -110.7604486 +1     2     1    18