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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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17567 505061 1 O3N5C27H27 A3B5C27D27 -7.57 3.02 -9.02 -0.74 0
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17568 505077 1 SN4O4C28H28 AB4C4D28E28 -52.33 7.76 -9.02 -1.01 0
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17569 505107 1 O2N4H18C25 A2B4C18D25 74.41 6.67 -9.26 -0.96 0
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17570 505156 1 Cl2O3N5H19C21 A2B3C5D19E21 -31.5 3.74 -9.53 -1.22 0
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17571 505302 1 Cl3O3N5H22C24 A3B3C5D22E24 -38.35 4.13 -8.77 -1.1 0
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17572 505374 1 SO17C39H66 AB17C39D66 -809.29 2.32 -9.9 -1.37 0
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17573 505396 1 NO4C25H31 AB4C25D31 -138.54 6.5 -7.85 -0.15 0
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17574 505525 1 N8H18C19 A8B18C19 156.75 5.79 -9.1 -0.94 0
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17575 505564 1 NCl2O4H25C26 AB2C4D25E26 -132.18 2.61 -9.11 -0.7 0
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17576 505620 1 Cl2N2O5C25H28 A2B2C5D25E28 -193.32 3.7 -9.34 -0.8 0
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17577 505714 1 NCl2O7C27H29 AB2C7D27E29 -276.46 5.66 -9.77 -1.35 0
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17578 505786 1 ICl2N2O2H5C15 AB2C2D2E5F15 17.41 2.26 -9.44 -2.15 0
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17579 505907 1 NO6C13H21 AB6C13D21 -263.06 6.01 -9.83 -0.27 0
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17580 506252 1 BrF3N3O4H17C22 AB3C3D4E17F22 -240.59 6.13 -9.36 -1.32 0
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17581 506262 1 FO3N4H19C21 AB3C4D19E21 -87.94 3.86 -8.79 -0.89 0
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17582 506264 1 ClO3N4H19C21 AB3C4D19E21 -50.78 7.32 -8.81 -0.88 0
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17583 506326 1 N3O5C27H29 A3B5C27D29 -149.26 4.53 -9.23 -1.24 0
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17584 506328 1 N3O5C28H31 A3B5C28D31 -153.92 6.0 -9.33 -1.28 0
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17585 506398 1 BrO3N4H19C21 AB3C4D19E21 -29.0 5.83 -9.1 -0.82 0
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17586 506400 1 ClO3N4H19C21 AB3C4D19E21 -41.09 7.13 -9.18 -1.02 0
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17587 506593 1 N2S3O8C16H24 A2B3C8D16E24 -332.5 9.18 -8.84 -0.24 0
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17588 506637 1 N6O6C37H46 A6B6C37D46 -184.12 3.18 -9.35 -1.21 0
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17589 506746 1 O6N7C35H51 A6B7C35D51 -246.13 7.76 -9.62 -1.65 0
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17590 506875 1 SCl2N3O3H11C15 AB2C3D3E11F15 -84.81 3.59 -8.97 -1.26 0
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17591 507022 1 FN3O4C12H12 AB3C4D12E12 -168.51 1.8 -9.85 -1.36 0
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17592 507026 1 SN2O2H18C21 AB2C2D18E21 10.97 6.67 -8.55 -0.78 0
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17593 507057 1 N9O9C35H59 A9B9C35D59 -412.97 10.35 -9.86 -0.75 0
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17594 507058 1 N9O9C34H55 A9B9C34D55 -380.8 15.41 -10.18 -0.96 0
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17595 507059 1 SN6O12C41H64 AB6C12D41E64 -577.69 10.31 -10.02 -0.69 0
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17596 507061 1 F5N6O13C41H63 A5B6C13D41E63 -912.71 13.35 -10.41 -1.33 0
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17597 507062 1 F5N6O13C42H65 A5B6C13D42E65 -928.47 7.18 -10.07 -0.6 0
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17598 507093 1 FON4C17H17 ABC4D17E17 -17.09 11.07 -10.01 -1.0 0
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17599 507094 1 FON4C18H19 ABC4D18E19 -18.33 11.07 -9.98 -1.18 0
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17600 507095 1 FON4C19H23 ABC4D19E23 -31.84 10.31 -10.05 -1.26 0
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17601 507096 1 FON4H13C14 ABC4D13E14 -5.22 11.28 -10.01 -1.03 0
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17602 507097 1 FON4H13C18 ABC4D13E18 31.32 10.87 -10.02 -1.06 0
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17603 507098 1 FO2N4H11C13 AB2C4D11E13 -40.39 9.68 -10.23 -1.2 0
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17604 507111 1 ON4C20H26 AB4C20D26 6.22 12.13 -9.8 -0.87 0
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17605 507116 1 ON5H21C22 AB5C21D22 78.34 11.99 -8.89 -0.78 0
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17606 507117 2 ON2C8H8 AB2C8D8 5.05 10.97 -9.95 -0.89 0
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17607 507264 1 Cl2N7O7C25H31 A2B7C7D25E31 -221.0 18.48 -8.7 -0.65 0
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17608 507268 1 Cl2O5N9C29H37 A2B5C9D29E37 -108.19 8.33 -8.48 -0.46 0
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17609 507303 1 NSC14H16 ABC14D16 33.43 2.49 0.0 0.0 1
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17610 507364 1 FN2O2H19C22 AB2C2D19E22 -28.25 5.33 -8.23 -0.56 0
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17611 507476 1 F3O4N6H21C24 A3B4C6D21E24 -120.15 9.31 -8.94 -1.58 0
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17612 507551 1 SN5O7C42H53 AB5C7D42E53 -287.86 8.91 -9.24 -0.34 0
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17613 507552 1 SN7O13C51H65 AB7C13D51E65 -570.78 6.53 -9.7 -0.36 0
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17614 507555 1 ClSN7O13C51H64 ABC7D13E51F64 -539.76 3.53 -9.1 -0.41 0
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17615 507738 1 O3N4C22H22 A3B4C22D22 -29.76 5.56 -9.11 -1.54 0
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17616 507863 1 FO4N5C26H28 AB4C5D26E28 -130.53 5.78 -9.04 -1.25 0