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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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186176 77399276 2 O5C9H10 A5B9C10 -358.91 9.47 -9.16 -0.77 0
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186177 77399353 1 SO5N6C22H36 AB5C6D22E36 -202.97 5.14 -8.87 -0.22 0
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186178 77399565 1 BrN2O4H15C20 AB2C4D15E20 -86.62 9.72 -9.49 -1.91 0
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186179 77399650 2 O2N3C15H15 A2B3C15D15 -48.18 3.76 -8.26 -0.87 0
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186180 77399755 1 FN2O3C27H29 AB2C3D27E29 -112.93 4.93 -8.69 -0.51 0
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186181 77399861 1 NO2C27H41 AB2C27D41 -98.3 2.21 -8.93 1.33 0
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186182 77399862 1 NO2C28H45 AB2C28D45 -143.81 2.32 -8.65 1.73 0
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186183 77400098 1 N3O5H25C35 A3B5C25D35 13.56 10.75 -8.95 -1.58 0
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186184 77400099 1 N3O4C28H31 A3B4C28D31 -93.02 4.5 -8.56 -0.99 0
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186185 77400351 1 BrSO3C14H15 ABC3D14E15 -101.43 2.03 -8.69 -1.12 0
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186186 77400352 2 N4O5C23H30 A4B5C23D30 -302.6 6.01 -8.63 -0.89 0
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186187 77400353 2 O3N4C21H26 A3B4C21D26 -174.51 1.31 -8.3 -0.67 0
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186188 77400776 1 FSN4O5H19C20 ABC4D5E19F20 -182.3 4.85 -8.31 -0.94 0
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186189 77400777 1 FSO3N4C11H13 ABC3D4E11F13 -119.52 1.21 -8.53 -0.72 0
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186190 77400778 1 SN4O4C13H16 AB4C4D13E16 -124.46 3.22 -8.38 -0.49 0
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186191 77400779 1 SN4O5H22C25 AB4C5D22E25 -95.38 4.78 -8.24 -0.86 0
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186192 77400780 1 SN4O6C17H22 AB4C6D17E22 -220.84 2.02 -8.01 -0.22 0
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186193 77401301 1 NO3C25H27 AB3C25D27 -78.11 5.03 -8.82 -0.66 0
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186194 77401965 2 N2O3C14H23 A2B3C14D23 -272.94 6.41 -8.52 0.32 0
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186195 77402153 1 N5O5C19H31 A5B5C19D31 -212.9 6.43 -9.54 -0.34 0
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186196 77402154 2 O2C10H15 A2B10C15 -166.14 7.07 -9.63 0.65 0
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186197 77402155 1 O5N6C19H36 A5B6C19D36 -219.99 6.76 -9.05 0.1 0
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186198 77402870 1 ClS2N4O6C31H33 AB2C4D6E31F33 -198.03 5.37 -8.64 -0.9 1
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186199 77402871 1 IN3O3H25C27 AB3C3D25E27 9.03 5.07 0.0 0.0 0
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186200 77402872 1 ClF2S2N4O5H25C30 AB2C2D4E5F25G30 -193.04 4.46 -8.85 -1.26 0