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

b3o3hcl2   2515 B3O3HCl2

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    #  Species Formula
  2505 Carbonyl chloride (Geo)COCl2
  2506 MethoxydichloroboraneH3BCOCl2
  2507 Be(II)Cl2 (ETBECL) (Geo)H10BeC4OCl2
  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 B3O3HCl2 HB3O3Cl2
  2516 Chlorine heptoxideO7Cl2
  2517 1,1',2,2'-Tetranitro-1,2-dichloroethaneC2N4O8Cl2
  2518 1,3-Dichloro-1,1,3,3-tetranitropropaneC3H2N4O8Cl2
  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


ΔHf: -353.4 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
B3O3HCl2
 H=-353.4 HR=PW91D
  B     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.39639808 +1    0.0000000 +0    0.0000000 +0     1     0     0
  B     1.40023535 +1  121.0574811 +1    0.0000000 +0     2     1     0
  O     1.40117907 +1  118.5506355 +1    0.1514768 +1     3     2     1
  B     1.39613166 +1  121.1598731 +1    0.0038808 +1     4     3     2
  O     1.40244845 +1  119.6355202 +1   -0.1728248 +1     5     4     3
 Cl     1.70555508 +1  119.8295570 +1 -179.8907308 +1     1     6     5
 Cl     1.70549260 +1  119.8741245 +1 -179.9344607 +1     5     6     1
  H     1.17455952 +1  121.0647043 +1 -179.8284542 +1     3     2     1