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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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82567 49856187 1 FN2C14H19 AB2C14D19 -27.22 3.55 -8.32 -0.06 0
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82568 49856188 1 FN2C14H19 AB2C14D19 -25.95 3.32 -8.44 -0.23 0
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82569 49856189 1 FN3C15H20 AB3C15D20 -13.54 3.51 -8.21 -0.28 0
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82570 49856190 1 FN2C13H17 AB2C13D17 -23.34 4.59 -8.52 -0.23 0
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82571 49856191 1 FN2C14H19 AB2C14D19 -27.07 4.56 -8.37 -0.12 0
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82572 49856196 1 PO2C26H35 AB2C26D35 -84.84 3.33 -8.27 0.06 0
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82573 49856198 1 SN5O9C40H47 AB5C9D40E47 -229.53 12.34 -9.17 -0.88 0
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82574 49856199 1 SF2N5O9C39H45 AB2C5D9E39F45 -396.6 14.89 -9.46 -1.36 0
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82575 49856200 1 SN5O9C40H45 AB5C9D40E45 -244.73 6.98 -9.15 -0.9 0
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82576 49856202 1 SF2N5O8C42H55 AB2C5D8E42F55 -401.75 7.87 -9.43 -0.86 0
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82577 49856203 1 SF2N5O10C38H45 AB2C5D10E38F45 -410.23 10.39 -9.84 -1.56 0
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82581 49856208 1 ClN2O4C6H12 AB2C4D6E12 -23.31 9.46 0.0 0.0 -3
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82582 49856209 1 ClNPO5C6H12 ABCD5E6F12 -72.7 7.8 0.0 0.0 0
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82583 49856210 1 CaKH5C6O8 ABC5D6E8 -449.7 12.19 -9.4 -0.09 0
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82584 49856211 1 KMgH5C6O8 ABC5D6E8 -423.26 10.17 -9.9 -0.91 0
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82585 49856212 1 CaNaH5C6O8 ABC5D6E8 -477.03 7.41 -9.86 -0.87 0
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82586 49856213 1 SN5O5C28H31 AB5C5D28E31 -117.52 6.49 -8.5 -1.4 0
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82587 49856214 1 SN5O5C27H29 AB5C5D27E29 -117.46 8.9 -8.39 -1.42 -1
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82588 49856215 1 N2O5C7H15 A2B5C7D15 -212.09 11.01 0.0 0.0 -1
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82589 49856216 1 N2O3C6H15 A2B3C6D15 -135.62 7.75 0.0 0.0 0
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82590 49856217 1 NNaO3C19H22 ABC3D19E22 -182.14 8.81 -8.92 -0.5 0
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82591 49856218 1 ClO4N6C30H35 AB4C6D30E35 -100.65 10.88 -8.68 -0.79 0
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82592 49856220 2 O3C16H30 A3B16C30 -389.64 3.85 -10.72 0.57 0
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82593 49856222 1 O6C45H86 A6B45C86 -451.18 4.36 -10.62 0.51 0
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82594 49856223 1 O5N8C41H42 A5B8C41D42 -65.32 4.79 -8.7 -0.53 0