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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165191 74514038 1 O4N5C16H18 A4B5C16D18 -88.58 3.9 0.0 0.0 0
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165192 74514576 1 F2N4O5C24H24 A2B4C5D24E24 -206.96 4.09 -9.17 -1.19 0
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165193 74515139 1 Cl2N3O4H11C16 A2B3C4D11E16 -17.02 5.13 -9.81 -1.71 0
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165194 74515440 1 SN2O6C25H26 AB2C6D25E26 -164.06 4.39 -8.76 -1.23 0
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165195 74515517 1 NSF2O4H13C15 ABC2D4E13F15 -196.83 9.98 -9.36 -1.34 0
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165196 74515518 1 NSF2O5C19H19 ABC2D5E19F19 -239.62 9.89 -9.19 -0.78 0
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165197 74515519 1 NSF3O3H12C16 ABC3D3E12F16 -202.13 9.19 -9.63 -1.23 0
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165198 74515667 1 FN2O4H15C16 AB2C4D15E16 -120.94 2.74 -9.09 -1.25 0
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165199 74515955 1 ClO2N4H23C24 AB2C4D23E24 4.95 6.77 -8.64 -0.69 0
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165200 74516239 2 FOH9C12 ABC9D12 -88.67 2.1 -9.64 -0.94 0
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165201 74516240 1 OSN2C6H6 ABC2D6E6 -4.9 2.21 -9.26 -0.83 0
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165202 74516241 1 ClNO3H14C17 ABC3D14E17 -75.52 4.05 -9.41 -1.22 0
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165203 74516242 1 ClINOH13C16 ABCDE13F16 23.06 4.6 -9.02 -1.05 0
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165204 74516243 1 S2N3H19C20 A2B3C19D20 160.21 5.3 -8.85 -1.34 -1
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165205 74516244 1 O2N4H13C15 A2B4C13D15 76.72 0.79 0.0 0.0 0
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165206 74516245 1 O2N4H14C15 A2B4C14D15 31.96 2.58 -9.35 -1.46 0
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165207 74516246 1 BrN3O4C11H12 AB3C4D11E12 -50.08 6.42 -9.0 -1.48 0
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165208 74516247 1 ClN3O4C11H12 AB3C4D11E12 -61.47 6.47 -8.93 -1.49 0
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165209 74516294 1 N3O4C10H11 A3B4C10D11 -40.54 3.79 -9.2 -1.51 0
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165210 74517218 1 SN2O5C14H20 AB2C5D14E20 -212.24 8.06 -9.59 -0.72 0
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165211 74517219 2 NOC9H13 ABC9D13 -75.14 5.54 -8.7 -0.65 0
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165212 74517605 1 SN4O4C20H20 AB4C4D20E20 -72.74 6.64 -8.76 -1.36 -1
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165213 74519245 1 Cl4N4O4H17C19 A4B4C4D17E19 -149.37 3.87 0.0 0.0 0
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165214 74519246 1 Cl2O3N4H10C11 A2B3C4D10E11 -125.03 3.03 -9.3 -0.79 0
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165215 74519617 1 NS3O5C23H23 AB3C5D23E23 -99.0 5.19 -7.48 -0.97 1