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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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166567 74710902 1 N2O2C17H22 A2B2C17D22 -87.89 3.0 -9.71 -0.08 0
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166568 74711220 1 NO5C24H31 AB5C24D31 -181.44 2.02 -8.71 -0.77 0
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166569 74711221 1 NO5C23H29 AB5C23D29 -176.52 0.7 -8.58 -0.82 0
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166570 74711222 1 NO5C25H33 AB5C25D33 -188.05 2.94 -8.64 -0.85 0
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166571 74711223 1 NO5C24H31 AB5C24D31 -182.6 1.73 -8.69 -0.78 0
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166572 74711224 1 NO5C24H31 AB5C24D31 -181.33 2.92 -8.67 -0.83 -1
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166573 74711225 1 NS2O5H16C17 AB2C5D16E17 -150.69 4.97 0.0 0.0 -1
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166574 74711226 1 NS2O4C16H16 AB2C4D16E16 -97.11 2.45 0.0 0.0 -1
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166575 74711227 1 N2S2O4C17H17 A2B2C4D17E17 -101.09 4.98 0.0 0.0 0
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166576 74711443 1 NSO4H21C23 ABC4D21E23 -81.22 4.88 -8.88 -1.46 1
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166577 74711476 1 N2O4C20H21 A2B4C20D21 -77.95 6.47 0.0 0.0 1
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166578 74711766 1 ClNO2C15H25 ABC2D15E25 -76.26 6.49 0.0 0.0 1
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166579 74711903 1 BrClNO2C18H22 ABCD2E18F22 -38.94 9.22 0.0 0.0 0
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166580 74712233 1 BrNO3C24H28 ABC3D24E28 -107.73 3.25 -8.82 -0.74 0
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166581 74712234 1 NCl2O4H19C24 AB2C4D19E24 -69.65 4.18 -9.4 -1.58 0
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166582 74712235 1 NO4H23C28 AB4C23D28 -45.71 2.66 -8.88 -1.43 -1
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166583 74712236 1 BrNO6H17C23 ABC6D17E23 -129.27 4.1 0.0 0.0 0
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166584 74712443 1 BrNSO4C27H30 ABCD4E27F30 -127.74 4.15 -8.65 -0.79 0
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166585 74712634 1 ClNO5C29H32 ABC5D29E32 -171.19 3.62 -8.47 -0.7 0
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166586 74712635 1 ClNO5C28H30 ABC5D28E30 -163.74 1.98 -8.41 -0.72 0
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166587 74712636 1 ClNO5C29H32 ABC5D29E32 -171.93 2.22 -8.38 -0.69 0
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166588 74712637 1 ClNO5C29H32 ABC5D29E32 -171.97 2.78 -8.42 -0.7 0
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166589 74712638 1 FNO5C26H26 ABC5D26E26 -187.13 6.26 -8.37 -0.91 1
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166590 74712970 1 O2N5C29H30 A2B5C29D30 64.33 25.04 0.0 0.0 0
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166591 74713032 1 SN3O3H15C16 AB3C3D15E16 -38.51 4.51 -9.16 -1.26 1