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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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128244 51036830 1 N5O5C34H43 A5B5C34D43 -188.27 2.46 -8.69 -0.32 0
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128245 51036831 1 O3N5C34H39 A3B5C34D39 -48.52 7.61 -8.72 -0.18 0
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128246 51036832 1 N7O7C36H45 A7B7C36D45 -252.47 6.76 -8.76 -0.52 0
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128247 51036833 1 N7O9C36H45 A7B9C36D45 -338.1 6.98 -8.76 -0.57 0
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128248 51036834 1 N7O9C36H45 A7B9C36D45 -344.09 3.58 -8.68 -0.54 0
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128249 51036835 1 N7O9C38H49 A7B9C38D49 -331.08 11.82 -8.51 -0.67 0
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128250 51036836 1 O6N9C50H67 A6B9C50D67 -254.41 3.59 -8.86 -0.98 0
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128251 51036837 1 O4N7C36H41 A4B7C36D41 -80.57 2.5 -8.49 -0.74 0
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128252 51036879 1 ClFN5H17C23 ABC5D17E23 89.56 7.63 -8.72 -0.99 1
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128253 51036902 1 N4O9C44H67 A4B9C44D67 -355.03 2.39 0.0 0.0 0
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128254 51036903 1 ClFO2N7H23C27 ABC2D7E23F27 10.13 11.62 -8.74 -1.19 0
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128255 51036904 1 O4N7C29H29 A4B7C29D29 -12.86 6.35 -8.34 -0.94 0
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128256 51036905 1 ClO2N7H24C27 AB2C7D24E27 58.35 10.04 -8.62 -1.22 0
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128257 51036906 1 ClO2N7H24C27 AB2C7D24E27 59.5 5.81 -8.68 -0.96 0
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128258 51036907 1 ClO2N7H24C27 AB2C7D24E27 57.77 10.93 -8.62 -1.2 0
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128259 51036908 1 O2N3F6C20H23 A2B3C6D20E23 -394.12 9.57 -9.52 -1.22 0
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128260 51036909 1 O2N3F6C22H27 A2B3C6D22E27 -414.93 3.26 -9.27 -1.53 0
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128261 51036910 1 O2N3F6C20H23 A2B3C6D20E23 -394.11 2.8 -9.36 -1.4 0
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128262 51036930 1 FSN4O5C30H41 ABC4D5E30F41 -241.24 8.74 -8.97 -1.14 0
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128263 51036931 1 FSN4O5C30H43 ABC4D5E30F43 -249.51 7.73 -8.85 -1.11 0
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128264 51036932 1 FSN4O5C28H39 ABC4D5E28F39 -237.11 8.66 -8.91 -1.11 0
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128265 51036951 1 ON7H21C25 AB7C21D25 122.43 3.41 -8.58 -0.94 0
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128266 51036952 1 ON5H19C23 AB5C19D23 80.14 3.02 -8.47 -0.72 0
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128267 51036991 1 N2O2H12C13 A2B2C12D13 -31.35 6.45 -9.0 -0.6 0
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128268 51037037 1 N5O8C47H63 A5B8C47D63 -304.66 5.42 -8.69 -0.69 0