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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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140763 52755379 1 SO2N3C27H27 AB2C3D27E27 15.17 4.06 -8.47 -0.65 0
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140764 52755748 1 SN3O4H23C24 AB3C4D23E24 -87.54 7.5 -8.38 -1.25 0
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140765 52755749 1 N3O4H21C22 A3B4C21D22 -66.09 1.63 -8.62 -0.65 0
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140766 52755750 1 N3O4H21C22 A3B4C21D22 -66.03 0.64 -8.66 -0.66 0
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140767 52755751 1 N3O3H19C22 A3B3C19D22 -31.29 2.08 -8.75 -0.96 0
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140768 52755960 1 ClN2O6C20H23 AB2C6D20E23 -203.49 4.09 -8.44 -0.72 0
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140769 52756823 1 N3O4C20H23 A3B4C20D23 -131.87 8.3 -8.86 -0.46 0
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140770 52757243 1 Cl2N2O3C21H22 A2B2C3D21E22 -107.22 4.5 -9.37 -1.07 0
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140771 52757366 1 N2O3C22H22 A2B3C22D22 -37.44 9.4 -8.49 -0.83 0
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140772 52757611 1 BrFSN2O4C17H18 ABCD2E4F17G18 -158.12 8.81 -9.61 -0.7 0
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140773 52757612 1 ClSN2O3F4H15C17 ABC2D3E4F15G17 -286.54 4.09 -10.01 -1.47 0
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140774 52757613 1 BrFSN2O3C17H18 ABCD2E3F17G18 -126.91 5.15 -9.83 -0.76 0
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140775 52757614 1 FSN2O5C24H25 ABC2D5E24F25 -175.75 7.35 -9.43 -0.62 0
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140776 52757971 1 SN3O4C20H27 AB3C4D20E27 -107.7 10.56 -9.13 -0.78 0
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140777 52758302 1 BrN3O3C20H24 AB3C3D20E24 -89.08 3.01 -8.89 -0.23 0
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140778 52758303 1 N3O5C21H25 A3B5C21D25 -149.17 2.87 -8.54 -0.27 1
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140779 52758759 1 O4N5C19H28 A4B5C19D28 -37.73 4.77 0.0 0.0 1
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140780 52758760 1 O4N5C19H28 A4B5C19D28 -34.42 8.64 0.0 0.0 0
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140781 52758761 1 O2N6C23H32 A2B6C23D32 -16.38 4.8 -8.5 -0.19 1
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140782 52758952 1 N2O4C23H31 A2B4C23D31 -108.05 6.46 0.0 0.0 0
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140783 52759281 2 NO2C9H12 AB2C9D12 -157.74 4.56 -9.06 -0.63 0
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140784 52759282 1 F2N2O3C17H22 A2B2C3D17E22 -220.36 5.22 -8.9 -0.39 0
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140785 52759510 1 SN4O5C17H26 AB4C5D17E26 -205.75 6.02 -9.18 -0.68 0
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140786 52759727 1 SN4O4C18H28 AB4C4D18E28 -176.12 1.71 -9.43 -0.5 0
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140787 52759806 1 SN4O5C16H24 AB4C5D16E24 -197.34 7.73 -9.16 -0.59 0