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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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411740 135084574 2 NOC13H14 ABC13D14 6.83 2.48 -8.63 -0.62 0
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411741 135084575 1 OSN5C41H41 ABC5D41E41 82.73 7.78 -8.22 -0.76 0
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411742 135084576 1 RhN2O7C30H32 AB2C7D30E32 -224.64 16.76 0.0 0.0 0
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411743 135084577 2 RhH4O4C9F14 AB4C4D9E14 -1758.91 17.34 -9.51 -6.04 0
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411745 135084579 2 AuClOPC21H28 ABCDE21F28 -147.24 9.82 -8.72 -2.13 0
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411746 135084580 1 PI4O5H25C31 AB4C5D25E31 -99.29 3.32 -8.09 -1.09 0
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411748 135084582 2 AuClPO4C37H51 ABCD4E37F51 -294.61 30.55 -6.6 -1.84 0
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411749 135084583 2 NOC17H18 ABC17D18 -1.83 0.85 -8.81 -0.76 0
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411750 135084584 1 TiN4C12H20 AB4C12D20 16.95 4.95 -8.46 -1.05 -2
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411751 135084585 1 ClNiP2N3C38H39 ABC2D3E38F39 107.28 7.23 0.0 0.0 0
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411752 135084586 1 P2N3C38H41 A2B3C38D41 106.74 2.78 -7.44 -0.61 1
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411753 135084587 1 BNOC9H13 ABCD9E13 -40.89 7.42 0.0 0.0 0
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411754 135084588 2 ORhC4H9 ABC4D9 -150.0 9.72 -9.96 -6.51 -1
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411755 135084589 1 BN2O2C16H18 AB2C2D16E18 -67.78 7.01 0.0 0.0 0
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411756 135084590 1 BN2O2C16H19 AB2C2D16E19 -88.05 5.19 -7.81 -0.66 0
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411758 135084592 1 IrON3C32H48 ABC3D32E48 42.59 32.23 -9.18 -3.8 0
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411759 135084593 1 IrON3C32H48 ABC3D32E48 43.91 30.66 -9.23 -3.84 0
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411760 135084594 1 SiN2O6C32H44 AB2C6D32E44 -241.83 2.15 -8.89 -0.54 2
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411761 135084595 1 PdN2P2F5H29C38 AB2C2D5E29F38 4.89 6.85 -6.84 -1.2 0
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411762 135084596 6 NC7H9 AB7C9 122.77 6.19 -7.63 0.04 0
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411763 135084597 1 PC27H27 AB27C27 82.62 1.52 -8.61 0.13 0
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411764 135084598 2 C3O3H4 A3B3C4 -232.22 4.25 -10.5 -1.47 0
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411765 135084599 1 NNaO3H6C7 ABC3D6E7 -47.14 6.33 -8.45 -1.04 0
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411766 135084600 1 BrO2C12H15 AB2C12D15 -57.24 1.65 -8.73 0.11 0
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411767 135084601 2 OC5H11 AB5C11 -137.29 1.06 -9.98 2.39 0