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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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436581 135205623 1 ClN2O5C24H29 AB2C5D24E29 -163.7 7.31 -8.74 -0.82 0
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436582 135205627 1 FSO2N7H24C28 ABC2D7E24F28 33.05 4.47 -8.73 -1.14 0
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436583 135205640 1 ClF3O4N6H26C29 AB3C4D6E26F29 -185.14 5.74 -8.43 -1.26 0
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436584 135205642 1 FCl2O4N6H19C24 AB2C4D6E19F24 -90.69 7.29 -9.46 -1.48 0
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436585 135205678 1 ClN5O5C31H32 AB5C5D31E32 -91.91 3.99 -8.3 -0.98 0
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436586 135205679 1 BrClF2N2H6C10 ABC2D2E6F10 -38.8 1.41 -9.5 -0.77 0
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436587 135205696 1 ON5C22H23 AB5C22D23 63.98 9.42 -8.61 -0.67 0
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436588 135205704 1 ClN5O5H26C28 AB5C5D26E28 -65.17 3.51 -8.28 -1.25 0
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436589 135205722 1 O2F3N3H6C9 A2B3C3D6E9 -100.85 6.32 -9.74 -1.69 0
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436590 135205762 1 BrClNOC12H13 ABCDE12F13 -16.31 6.41 -8.81 -0.42 0
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436591 135205764 2 N2O3C14H15 A2B3C14D15 -190.79 5.93 -9.45 -1.06 0
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436592 135205771 1 ClFN4O6C30H30 ABC4D6E30F30 -207.51 9.23 -9.1 -1.13 0
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436593 135205812 1 FN4O5C30H35 AB4C5D30E35 -220.17 7.19 -9.24 -0.7 0
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436594 135205819 1 BrNO4C14H20 ABC4D14E20 -170.18 5.7 -8.75 -0.9 0
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436595 135205851 1 Cl2O3N6H24C28 A2B3C6D24E28 11.04 6.3 -8.75 -1.31 0
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436596 135205869 1 N3O4F6H23C29 A3B4C6D23E29 -380.54 7.65 -9.53 -0.9 0
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436597 135205891 1 O2N3C21H21 A2B3C21D21 0.61 5.98 -8.69 -0.15 0
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436598 135205896 2 OC9H13 AB9C13 -87.27 0.2 -9.15 0.33 0
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436599 135205905 1 CaNCl2O3C9H13 ABC2D3E9F13 -213.37 3.21 -8.74 -0.45 0
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436600 135205945 1 ON5H19C21 AB5C19D21 70.38 4.18 -8.78 -0.48 0
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436601 135205946 1 N4O5C23H32 A4B5C23D32 -132.17 3.53 -9.54 -0.27 0
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436602 135205953 1 F4N4O5H24C29 A4B4C5D24E29 -313.97 9.7 -9.24 -1.29 0
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436603 135205969 1 ClF3O4N6H20C27 AB3C4D6E20F27 -160.12 6.29 -8.96 -2.01 0
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436604 135206007 1 O4C21H28 A4B21C28 -198.25 9.92 -9.7 -0.38 0
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436605 135206013 1 N5O8C35H39 A5B8C35D39 -211.3 6.94 -8.74 -0.76 0
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436606 135206014 1 ClFO4N6H26C28 ABC4D6E26F28 -66.97 3.73 -8.46 -1.2 0
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436607 135206033 1 Cl2N4O6H24C27 A2B4C6D24E27 -152.65 5.08 -9.26 -1.36 0
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436608 135206037 1 ClN3O7C31H34 AB3C7D31E34 -210.25 4.17 -8.92 -0.98 0
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436609 135206048 1 ClF3O5N6H20C25 AB3C5D6E20F25 -233.03 8.11 -9.06 -1.98 0
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436611 135206080 1 ClF3N6O6H24C27 AB3C6D6E24F27 -267.85 6.89 -9.03 -1.91 0
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436612 135206095 1 ClN2O6C25H29 AB2C6D25E29 -183.0 7.86 -8.69 -0.98 0
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436613 135206101 1 ClSF3O4N5C16H17 ABC3D4E5F16G17 -219.97 3.0 -9.22 -1.72 0
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436614 135206119 1 NO5C44H83 AB5C44D83 -373.57 3.82 -9.33 0.35 1
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436615 135206127 1 NPC7H17 ABC7D17 -13.67 0.58 0.0 0.0 0
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436616 135206157 1 N3O4C29H43 A3B4C29D43 -177.46 7.28 -8.61 -0.37 0
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436617 135206163 1 ClFNOH13C14 ABCDE13F14 -48.34 3.27 -9.71 -0.7 0
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436618 135206170 1 F2O4N5C36H39 A2B4C5D36E39 -164.5 5.49 -8.77 -0.92 0
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436619 135206194 1 BrClFHINC5 ABCDEFG5 7.96 0.87 -10.01 -1.76 0
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436620 135206199 1 FN3O4C29H42 AB3C4D29E42 -220.62 7.39 -8.74 -0.49 0
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436621 135206218 1 N3O4C29H43 A3B4C29D43 -165.0 8.85 -8.24 -0.32 0
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436622 135206225 1 FN3O4C31H40 AB3C4D31E40 -174.19 9.0 -8.41 -0.45 0
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436623 135206229 2 N2O4C9H16 A2B4C9D16 -361.15 4.01 -9.6 -0.52 0
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436624 135206230 1 ClFO3N4C32H44 ABC3D4E32F44 -171.24 7.04 -9.01 -0.79 0
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436625 135206245 2 FNO2C13H17 ABC2D13E17 -250.78 6.0 -9.14 -0.53 0
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436626 135206282 1 F3N3O3C34H46 A3B3C3D34E46 -267.65 5.97 -8.61 -0.4 0
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436627 135206283 1 F2N2O5C34H42 A2B2C5D34E42 -281.95 7.01 -8.58 -0.4 0
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436628 135206318 1 N3O3C32H49 A3B3C32D49 -156.18 3.15 -8.7 -0.3 0
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436629 135206319 1 FN3O4C31H46 AB3C4D31E46 -231.9 2.23 -8.6 -0.35 0
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436630 135206324 1 N2O4C33H42 A2B4C33D42 -147.22 5.82 -8.81 -0.25 0
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436631 135206335 1 N3O4C29H43 A3B4C29D43 -170.51 7.26 -8.41 -0.23 0
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436632 135206336 1 ClFN3O4C32H39 ABC3D4E32F39 -194.04 4.77 -9.07 -0.66 0
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436633 135206343 1 N3O4C29H43 A3B4C29D43 -187.64 6.55 -9.14 -0.53 0
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436634 135206345 2 FNO2C14H19 ABC2D14E19 -261.12 8.38 -8.76 -0.44 0
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436635 135206409 1 N3O4C32H41 A3B4C32D41 -128.83 6.91 -8.61 -0.36 0
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436636 135206417 2 N2O2C12H17 A2B2C12D17 -138.1 8.11 -9.11 -0.92 0
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436637 135206421 1 O4N6C41H58 A4B6C41D58 -165.08 5.91 -8.54 -0.11 0
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436638 135206442 1 FN3O4C32H40 AB3C4D32E40 -180.56 7.26 -8.4 -0.65 0
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436639 135206445 1 F2N2O4C33H40 A2B2C4D33E40 -233.24 7.29 -8.67 -0.46 0
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436640 135206448 2 NF2O2C17H20 AB2C2D17E20 -357.5 3.99 -9.14 -0.84 0
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436641 135206479 1 FO3N4C28H41 AB3C4D28E41 -178.84 7.76 -8.65 -0.42 0
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436642 135206480 1 FN3O5C32H40 AB3C5D32E40 -213.94 9.51 -8.67 -0.54 0
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436643 135206526 2 O2N3C19H23 A2B3C19D23 -95.27 7.05 -8.57 -0.8 0
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436644 135206527 1 ClO3N5C43H60 AB3C5D43E60 -136.78 8.43 -8.34 -0.11 0
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436645 135206529 1 FN3O4C28H40 AB3C4D28E40 -215.32 7.61 -8.87 -0.52 0
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436646 135206530 2 O2N3C19H23 A2B3C19D23 -94.83 7.29 -8.53 -0.83 0
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436647 135206541 1 N2O5C26H34 A2B5C26D34 -190.85 6.26 -8.88 -0.39 0
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436648 135206569 1 ClFN3O3C37H47 ABC3D3E37F47 -171.12 5.75 -8.89 -0.5 0
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436649 135206581 1 FN3O4C33H42 AB3C4D33E42 -191.49 5.02 -8.83 -0.28 0
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436650 135206597 1 ClO3N4C47H61 AB3C4D47E61 -116.24 7.23 -8.81 -0.3 0
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436651 135206606 1 ClO4N7C44H60 AB4C7D44E60 -139.11 7.8 -8.69 -0.44 0
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436652 135206624 1 BrN2O4C19H27 AB2C4D19E27 -159.17 6.73 -9.07 -0.78 0
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436653 135206632 1 O3N7C37H45 A3B7C37D45 -42.96 6.33 -8.59 -1.27 0
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436654 135206637 1 ClN3O4C39H52 AB3C4D39E52 -164.15 9.42 -8.33 -0.14 0
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436655 135206639 1 ClO3N4C46H59 AB3C4D46E59 -106.12 7.31 -8.81 -0.43 0
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436656 135206665 1 N3O4C29H43 A3B4C29D43 -181.35 6.88 -8.58 -0.32 0