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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228761 87565692 1 FSN2O2C20H21 ABC2D2E20F21 -31.09 4.23 -9.12 -0.7 0
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228762 87565693 1 S2N3F6O6H21C31 A2B3C6D6E21F31 -427.79 11.99 -8.81 -1.54 0
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228763 87565697 1 O6C7H12 A6B7C12 -265.43 5.64 -10.76 -0.5 0
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228764 87565703 1 SF3N3O5C18H24 AB3C3D5E18F24 -338.73 3.41 -8.92 -0.71 0
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228765 87565704 1 SN3O3C16H23 AB3C3D16E23 -99.81 2.73 -8.85 -0.17 0
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228766 87565705 1 SF2N2O2C18H18 AB2C2D2E18F18 -82.06 4.2 -9.01 -1.46 0
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228767 87565714 1 FSN3O4C27H32 ABC3D4E27F32 -129.6 4.26 -8.8 -0.26 0
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228768 87565717 2 O3C5H11 A3B5C11 -293.7 4.22 -9.98 0.51 0
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228769 87565719 1 N2O2F7H25C27 A2B2C7D25E27 -400.04 8.91 -9.62 -0.95 0
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228770 87565726 1 SCl2O2N3C9H9 AB2C2D3E9F9 -37.32 1.36 -9.01 -0.7 0
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228771 87565729 1 NPS2O3C8H14 ABC2D3E8F14 -163.28 2.82 -9.54 -0.6 1
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228772 87565735 1 S2N3O5F6H14C19 A2B3C5D6E14F19 -425.56 8.16 0.0 0.0 0
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228773 87565736 2 O4C8H17 A4B8C17 -393.56 4.78 -9.63 0.61 -1
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228774 87565739 1 N2O5C10H11 A2B5C10D11 -106.01 2.07 0.0 0.0 1
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228775 87565742 1 N2O5C10H13 A2B5C10D13 -140.51 3.97 0.0 0.0 0
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228776 87565747 1 SCl2O4H8C9 AB2C4D8E9 -127.72 3.24 -10.31 -1.47 0
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228777 87565750 2 H5C6 A5B6 126.82 1.37 -8.62 -0.52 0
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228778 87565762 1 O9C12H22 A9B12C22 -428.96 5.37 -10.48 -0.24 0
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228779 87565763 1 O9C20H40 A9B20C40 -452.8 8.76 -9.8 -0.29 0
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228780 87565764 1 ClFSN3O3C26H31 ABCD3E3F26G31 -104.91 7.63 -8.87 -0.32 0
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228781 87565765 1 FSN3O3C26H30 ABC3D3E26F30 -75.79 3.76 -8.9 -0.27 0
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228782 87565767 2 BrNO2H16C18 ABC2D16E18 -116.72 0.6 -9.41 -2.81 0
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228783 87565770 1 OCl2C6H12 AB2C6D12 -60.06 2.67 -10.14 -0.22 0
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228784 87565774 1 NTiCl2C14H25 ABC2D14E25 94.16 10.36 -6.78 -1.36 0
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228785 87565782 2 O4C7H16 A4B7C16 -366.28 2.78 -9.73 1.58 0