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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177027 76126220 4 OC2H4 AB2C4 -194.77 1.64 -10.24 -0.32 0
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177028 76126221 1 SN5O7C41H53 AB5C7D41E53 -272.64 4.39 -9.02 -0.64 0
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177029 76126222 1 NO11C32H51 AB11C32D51 -481.54 9.45 -8.59 -0.66 0
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177030 76126223 1 SO2N10C11H18 AB2C10D11E18 84.74 2.58 -8.9 -1.08 0
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177031 76126720 1 N2O5C26H26 A2B5C26D26 -102.54 6.22 -9.3 -0.53 1
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177032 76126721 1 FS3O5N8C32H34 AB3C5D8E32F34 -36.68 8.96 0.0 0.0 0
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177033 76126722 1 NPO7C25H30 ABC7D25E30 -270.87 8.03 -8.69 -0.28 0
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177034 76126723 1 NOSC11H21 ABCD11E21 -54.32 1.51 -8.72 0.5 0
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177035 76127579 1 NO4C19H29 AB4C19D29 -179.5 5.51 -9.04 0.53 0
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177036 76127979 1 S2O5N10C23H28 A2B5C10D23E28 -16.01 11.45 -7.66 -0.87 0
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177037 76128053 1 NSiO9C41H71 ABC9D41E71 -506.47 1.78 -9.21 -0.24 0
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177038 76128100 1 S2N5O6C32H41 A2B5C6D32E41 -234.23 2.03 -8.7 -1.36 0
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177039 76128369 1 O3N4H22C26 A3B4C22D26 -1.56 3.6 -8.3 -0.27 0
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177040 76129046 1 PSiN5O9C50H58 ABC5D9E50F58 -304.52 6.35 -8.7 -0.03 1
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177041 76129077 1 S3N8O8H23C24 A3B8C8D23E24 -146.52 9.79 0.0 0.0 0
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177042 76129078 2 OC13H13 AB13C13 -20.4 1.22 -8.7 -0.66 0
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177043 76129285 1 N2O3C17H18 A2B3C17D18 -79.06 4.62 -9.24 -0.38 0
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177044 76129286 1 ClFN3O4C23H27 ABC3D4E23F27 -146.47 7.57 -9.02 -0.42 0
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177045 76129509 3 NOC7H9 ABC7D9 -47.7 5.85 -8.65 -0.13 0
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177046 76130276 2 NOC32H34 ABC32D34 113.6 4.07 -8.0 0.22 0
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177047 76130277 2 O3C9H11 A3B9C11 -257.9 8.26 -9.99 -1.16 0
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177048 76130278 1 N3O4C21H27 A3B4C21D27 -112.17 2.96 -9.26 -0.24 0
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177049 76130312 1 N3O6C32H43 A3B6C32D43 -275.34 5.07 -9.83 -0.44 0
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177050 76130357 1 SN2O8C26H26 AB2C8D26E26 -255.36 3.89 -9.02 -1.66 0
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177051 76130398 1 O5C23H42 A5B23C42 -289.94 5.06 -10.04 0.37 0