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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180791 76686409 2 O2C10H17 A2B10C17 -213.39 7.35 -9.98 0.57 0
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180792 76686542 1 NO6C42H75 AB6C42D75 -354.84 3.86 -8.99 0.68 0
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180793 76686600 1 O2N5C29H29 A2B5C29D29 25.66 5.81 -8.49 -0.83 0
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180794 76686834 1 O7N10C42H80 A7B10C42D80 -400.55 7.79 -9.33 -0.2 0
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180795 76686848 1 N11O12C52H85 A11B12C52D85 -580.7 13.02 -8.9 -0.55 0
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180796 76686849 1 N7O10C49H83 A7B10C49D83 -529.41 6.14 -9.16 -0.06 0
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180797 76686850 1 N11O13C62H101 A11B13C62D101 -632.43 9.38 -8.96 -0.53 0
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180798 76687413 1 INO9C24H34 ABC9D24E34 -349.14 7.11 -8.77 -0.89 0
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180799 76687578 1 NSO7C43H65 ABC7D43E65 -352.65 8.18 -8.94 -0.18 0
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180800 76687611 1 NO15C47H57 AB15C47D57 -544.25 8.41 -9.1 -0.43 0
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180801 76688308 1 NO4C12H21 AB4C12D21 -206.32 4.98 -10.13 0.3 0
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180802 76688309 1 OC22H28 AB22C28 -31.26 2.44 -9.3 0.28 0
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180803 76688310 1 S2N3O3C31H31 A2B3C3D31E31 -2.34 7.43 -8.89 -0.77 0
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180804 76688333 1 SN2O2C25H30 AB2C2D25E30 -21.57 3.82 -8.62 -0.41 0
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180805 76688985 1 NSO3C29H45 ABC3D29E45 -179.73 3.22 -8.73 -0.17 0
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180806 76689074 1 ClSN3O9C42H52 ABC3D9E42F52 -330.72 9.63 -8.92 -0.76 0
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180807 76689279 1 ClNSO4H20C21 ABCD4E20F21 -118.34 8.5 -8.79 -0.87 0
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180808 76689415 1 O3N5C15H21 A3B5C15D21 2.99 8.15 -8.32 -1.16 -1
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180809 76689416 1 YN2O3C12H19 AB2C3D12E19 -83.98 5.39 -6.07 0.04 -1
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180810 76689529 1 NYO3H14C16 ABC3D14E16 38.4 5.28 -5.79 -0.62 0
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180811 76689530 1 N2O3C13H18 A2B3C13D18 -87.13 5.57 -8.27 0.31 0
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180812 76689531 1 N2O3C11H14 A2B3C11D14 -79.97 2.53 -8.76 0.06 0
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180813 76689532 1 ClSN2O2C18H21 ABC2D2E18F21 -24.92 2.89 -8.14 -0.2 -1
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180814 76690054 1 IrN3C14H18 AB3C14D18 196.84 7.63 -8.83 -4.79 -2
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180815 76690386 1 IrSYN2H14C17 ABCD2E14F17 84.18 7.99 -9.2 -4.39 -2