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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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230072 87570018 1 FSN2O4H7C9 ABC2D4E7F9 -100.63 6.21 -9.4 -1.33 0
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230073 87570019 1 BrF2N2O2H7C10 AB2C2D2E7F10 -135.9 4.95 -9.45 -2.03 0
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230074 87570023 1 NF2O4H17C19 AB2C4D17E19 -147.79 4.83 -8.67 -0.53 0
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230075 87570026 8 COH2 ABC2 -272.5 2.99 -9.88 -0.65 0
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230076 87570029 1 NO6C18H23 AB6C18D23 -188.43 5.93 -9.93 -0.81 0
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230077 87570032 2 O6C23H26 A6B23C26 -236.72 2.42 -8.84 0.21 1
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230078 87570041 1 ClNOC21H25 ABCD21E25 -6.87 7.45 0.0 0.0 0
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230079 87570053 2 ClSN2O2C12H16 ABC2D2E12F16 -142.2 1.79 -8.43 -1.21 0
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230080 87570054 1 OSC6H12 ABC6D12 -41.42 4.52 -8.86 -0.59 0
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230081 87570067 1 N2C9H18 A2B9C18 -6.97 4.1 -8.53 1.08 0
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230083 87570082 1 FS2O3N6H15C17 AB2C3D6E15F17 -56.63 4.29 -9.3 -1.45 0
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230084 87570084 1 NO6C25H31 AB6C25D31 -186.95 8.9 -8.94 -0.37 0
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230085 87570095 1 BrN2O4H7C12 AB2C4D7E12 51.01 7.3 -10.18 -1.71 0
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230086 87570098 1 O5C10H18 A5B10C18 -163.49 2.6 -9.69 -0.35 0
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230087 87570102 1 NOSiC31H49 ABCD31E49 -42.57 3.93 -8.22 0.01 0
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230088 87570105 1 ClN4H11C13 AB4C11D13 96.88 7.32 -8.85 -1.26 0
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230090 87570118 1 NO2C36H73 AB2C36D73 -262.1 2.59 -9.79 0.97 0
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230091 87570119 1 NO4C6H9 AB4C6D9 -173.09 7.16 -9.58 -0.13 0
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230092 87570130 1 ClN4H13C14 AB4C13D14 75.21 6.81 -8.8 -0.9 0
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230093 87570140 2 ClON3C4H10 ABC3D4E10 10.95 3.62 -9.34 -1.37 0
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230094 87570142 1 NaSO2C3H7 ABC2D3E7 -118.64 8.39 -8.02 0.34 0
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230095 87570150 1 ClOF3N3H13C15 ABC3D3E13F15 -137.4 1.74 -8.94 -1.48 0
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230096 87570152 1 ClSO2N3C18H20 ABC2D3E18F20 -50.9 1.48 -8.77 -0.84 0
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230097 87570153 1 ClN5H14C16 AB5C14D16 121.5 3.52 -8.85 -0.77 0
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230098 87570164 1 ClSF3N3O4H19C20 ABC3D3E4F19G20 -250.66 7.59 -9.38 -1.16 0