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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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135412 51868413 1 O2N3C23H31 A2B3C23D31 -70.56 4.53 -9.17 -0.83 0
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135413 51868510 1 SN2O3C14H16 AB2C3D14E16 -75.48 3.19 -9.13 -0.49 0
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135414 51868511 1 OSN3C20H21 ABC3D20E21 44.45 2.87 -8.95 -0.56 0
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135415 51868872 1 SN3O3C21H31 AB3C3D21E31 -110.26 4.09 -9.34 -0.45 1
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135416 51868918 1 S2N3O3C23H34 A2B3C3D23E34 -92.65 4.29 0.0 0.0 0
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135417 51869318 2 N2O2C13H16 A2B2C13D16 -138.59 6.77 -8.06 -0.48 0
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135418 51869389 1 NO5C12H17 AB5C12D17 -165.24 11.27 -8.72 -0.69 0
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135419 51869453 1 SN3O5C22H23 AB3C5D22E23 -138.21 3.32 -8.2 -0.78 0
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135420 51869699 1 SN2O4C18H26 AB2C4D18E26 -165.41 6.83 -9.79 -1.01 0
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135421 51869700 1 OSN5H25C26 ABC5D25E26 94.26 7.51 -8.49 -1.47 0
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135422 51869777 1 N3O5C24H33 A3B5C24D33 -234.3 4.91 -9.33 -0.66 0
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135423 51869884 1 O2S3N4C18H20 A2B3C4D18E20 26.76 5.35 -8.51 -0.81 0
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135424 51869885 1 O2S3N4C18H20 A2B3C4D18E20 27.24 2.5 -8.52 -1.03 0
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135425 51870025 1 NO4C15H15 AB4C15D15 -93.45 2.85 -8.82 -0.42 0
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135426 51870026 1 NF3O3H16C18 AB3C3D16E18 -225.45 4.9 -8.91 -0.82 0
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135427 51870213 1 N3O3C27H37 A3B3C27D37 -150.54 4.11 -8.64 0.07 0
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135428 51870214 1 N3O3C27H37 A3B3C27D37 -149.84 7.13 -8.65 0.22 0
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135429 51870215 1 N3O4C21H31 A3B4C21D31 -187.72 5.7 -8.92 -0.06 0
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135430 51870216 1 N3O4C21H31 A3B4C21D31 -190.85 3.48 -8.7 0.14 0
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135431 51870217 1 SN3O4C21H33 AB3C4D21E33 -179.39 6.49 -9.18 -0.52 0
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135432 51870218 1 SN3O4C21H33 AB3C4D21E33 -177.54 7.26 -9.15 -0.61 0
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135433 51870219 1 SN2O2C21H32 AB2C2D21E32 -107.08 7.71 -9.04 -0.52 0
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135434 51870220 1 SN2O2C21H32 AB2C2D21E32 -107.23 7.57 -9.04 -0.54 0
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135435 51870253 1 FN3O3C20H28 AB3C3D20E28 -180.32 3.54 -9.25 -0.61 0
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135436 51870413 1 SN2O2C18H18 AB2C2D18E18 -0.32 3.95 -9.1 -1.11 -1