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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149956 53789638 1 N3O4C20H23 A3B4C20D23 -115.87 5.74 -7.97 -0.65 0
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149957 53789640 2 NOC5H7 ABC5D7 -72.62 6.63 -9.78 0.17 0
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149958 53789641 2 ON4C19H30 AB4C19D30 75.44 7.23 -6.97 -0.15 0
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149959 53789642 2 NC6H9 AB6C9 14.49 2.65 -8.59 -0.05 0
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149960 53789643 1 ON3C13H21 AB3C13D21 8.57 2.13 -8.82 -0.01 0
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149961 53789644 1 ON3C13H21 AB3C13D21 8.0 1.92 -8.77 -0.02 0
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149962 53789645 1 O2F3N5C10H10 A2B3C5D10E10 -94.73 3.0 -10.03 -1.59 0
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149963 53789646 1 NO4C17H21 AB4C17D21 -149.88 2.88 -8.57 -1.34 0
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149964 53789647 2 NSH5O5C10 ABC5D5E10 -151.6 10.15 -10.7 -2.64 0
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149965 53789648 1 O3S3N8H10C17 A3B3C8D10E17 241.05 4.15 -9.64 -2.71 0
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149966 53789649 1 OF2N6C14H16 AB2C6D14E16 -18.94 7.18 -9.9 -0.72 0
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149967 53789650 1 O6C13H22 A6B13C22 -310.16 6.52 -11.05 -0.19 0
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149968 53789651 2 NOC11H12 ABC11D12 -14.53 1.52 -8.34 -1.2 0
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149969 53789652 1 BrO5C28H31 AB5C28D31 -182.3 3.87 -8.44 -0.95 0
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149970 53789653 1 SO3C20H34 AB3C20D34 -181.38 6.03 -8.5 0.53 0
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149971 53789654 1 SN2F4O5H22C27 AB2C4D5E22F27 -307.38 2.62 -8.68 -1.35 0
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149972 53789655 1 SN2F4O5H22C27 AB2C4D5E22F27 -308.45 2.56 -8.61 -1.37 0
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149973 53789656 1 ClNF2O3H16C19 ABC2D3E16F19 -163.21 4.09 -9.58 -0.92 0
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149974 53789657 2 OH8C9 AB8C9 -28.87 0.87 -8.32 -0.37 0
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149975 53789658 1 N5O6C26H33 A5B6C26D33 -194.23 4.12 -8.65 -1.36 0
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149976 53789659 1 SCl2N2F3O3H19C24 AB2C2D3E3F19G24 -190.63 6.91 -8.89 -1.52 1
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149977 53789660 1 N3O4C19H22 A3B4C19D22 -89.07 3.23 0.0 0.0 0
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149978 53789661 1 O2N3F5H12C20 A2B3C5D12E20 -257.2 4.98 -9.58 -1.24 0
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149979 53789662 1 FN2C14H21 AB2C14D21 -43.88 1.0 -9.1 -0.06 0
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149980 53789663 1 NF3O3C20H24 AB3C3D20E24 -250.2 6.63 -8.39 -0.52 0