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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144547 53383502 1 ON5H23C29 AB5C23D29 110.27 3.2 -9.18 -1.45 0
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144548 53383503 1 ON5H19C23 AB5C19D23 82.14 3.59 -9.08 -1.49 0
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144549 53384464 1 O2N5H13C14 A2B5C13D14 121.48 7.35 -8.88 -1.24 0
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144550 53384498 1 N2O5C24H30 A2B5C24D30 -157.82 5.09 -9.27 -0.4 0
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144551 53384626 1 BClOC2F3H5 ABCD2E3F5 -340.26 1.83 -11.12 -0.26 0
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144552 53384695 1 ClO3N4H15C23 AB3C4D15E23 85.55 5.62 -9.17 -1.75 0
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144553 53384726 1 Cl2S2O3N4C18H18 A2B2C3D4E18F18 -61.05 7.15 -9.02 -1.63 0
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144554 53384813 1 ClN2F3O3C18H18 AB2C3D3E18F18 -259.06 4.66 -9.18 -0.45 0
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144555 53385005 1 F3N4O4H31C33 A3B4C4D31E33 -211.1 6.07 -8.32 -0.92 0
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144556 53385060 1 OF2N4H24C29 AB2C4D24E29 -24.11 3.22 -8.43 -0.52 0
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144559 53386075 1 NP2O7C19H33 AB2C7D19E33 -427.85 3.08 -9.44 0.21 0
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144560 53386076 1 NP2O7C20H35 AB2C7D20E35 -431.72 2.38 -8.96 0.47 0
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144561 53386077 1 NP2O7C20H35 AB2C7D20E35 -435.37 2.12 -9.11 0.33 0
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144562 53386078 1 NP2O8C20H35 AB2C8D20E35 -470.67 2.98 -8.73 0.14 0
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144563 53386327 1 N11O19C40H65 A11B19C40D65 -915.57 13.26 -10.15 -0.24 0
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144564 53386471 1 O4C27H32 A4B27C32 -141.23 8.89 -9.0 -0.3 0
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144565 53386472 1 ClO6H17C22 AB6C17D22 -180.33 2.53 -9.45 -1.81 0
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144566 53386473 1 O3C16H16 A3B16C16 -95.2 6.81 -9.44 -0.3 0
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144567 53386492 1 SiO3C18H36 AB3C18D36 -228.9 3.1 -8.76 0.93 0
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144568 53386493 1 NOC14H23 ABC14D23 -46.57 1.73 -8.81 0.32 0
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144569 53386640 1 O3C11H12 A3B11C12 -91.19 3.18 -8.65 0.05 0
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144570 53386641 1 IN2H17C20 AB2C17D20 102.91 1.62 -8.16 -0.81 0
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144571 53386642 1 N2H22C25 A2B22C25 137.85 3.1 -7.97 -0.38 0
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144572 53386701 1 NOH21C30 ABC21D30 129.27 2.54 -8.8 -0.84 0
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144573 53386702 1 NO2H15C16 AB2C15D16 -41.16 4.38 -8.69 -0.09 0
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144574 53386703 1 NOH17C23 ABC17D23 81.24 3.08 -8.9 -0.26 0
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144575 53386789 1 O2N6H16C17 A2B6C16D17 19.69 3.75 -9.15 -0.62 0
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144576 53386790 2 ON3C5H6 AB3C5D6 -19.4 1.3 -9.11 -0.54 0
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144577 53386791 1 NSiO4C12H23 ABC4D12E23 -240.11 4.51 -8.94 0.14 0
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144578 53386792 1 NSiO3C11H23 ABC3D11E23 -205.5 3.28 -8.88 0.62 0
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144579 53386793 1 NSiO3C18H27 ABC3D18E27 -166.58 3.71 -8.94 0.1 0
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144580 53386794 1 O6N7C29H29 A6B7C29D29 -59.1 7.3 -9.26 -1.45 0
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144581 53386819 1 ClO4H21C26 AB4C21D26 -82.18 4.71 -9.27 -0.55 0
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144582 53386820 1 ClO5H21C26 AB5C21D26 -105.32 6.6 -9.02 -0.53 0
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144583 53386857 1 NOH23C30 ABC23D30 106.93 2.81 -8.68 -0.19 0
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144584 53386954 1 ClNOH18C21 ABCD18E21 66.0 6.08 -8.88 -0.68 0
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144585 53387057 1 O3C17H22 A3B17C22 -128.82 3.52 -8.25 0.09 0
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144586 53387058 1 O2N3C7H7 A2B3C7D7 -2.77 7.01 -8.77 -0.86 0
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144587 53387059 3 NOC4H5 ABC4D5 -63.88 5.65 -8.86 -0.81 0
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144588 53387060 1 ClO2N3C12H14 AB2C3D12E14 -31.06 4.46 -9.02 -1.17 0
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144589 53387239 1 FON2H11C15 ABC2D11E15 76.26 4.41 -8.85 -0.74 0
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144590 53387435 1 ON6C12H16 AB6C12D16 113.57 5.37 -9.2 -0.17 0
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144591 53387436 1 N2C11H18 A2B11C18 10.95 1.75 -9.31 0.34 0
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144592 53387437 1 FN2C11H17 AB2C11D17 -37.13 1.69 -9.41 -0.07 0
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144593 53387438 2 NC6H10 AB6C10 1.22 2.24 -9.03 0.4 0
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144594 53387449 1 NSF2O2H17C18 ABC2D2E17F18 -127.55 1.81 -9.11 -0.4 0
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144595 53387450 1 NSO2F6H17C20 ABC2D6E17F20 -357.17 4.47 -9.41 -1.02 0
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144596 53387519 1 N3H13C15 A3B13C15 104.49 5.3 -8.46 -0.79 0
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144597 53387581 1 NO3C15H23 AB3C15D23 -151.83 1.04 -9.11 0.1 0
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144598 53387944 1 OC10H18 AB10C18 -65.05 1.24 -9.73 1.28 0
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144599 53387945 1 OC11H20 AB11C20 -69.84 1.24 -9.72 1.29 0
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144600 53387946 1 SiS2O9C45H50 AB2C9D45E50 -315.68 5.79 -8.97 -0.66 0
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144601 53387982 1 N3O3C14H17 A3B3C14D17 -76.68 6.96 -8.66 -1.1 0
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144602 53387983 1 N3O4C15H19 A3B4C15D19 -119.68 5.51 -9.15 -1.01 0
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144603 53387984 1 ClN3O3C20H22 AB3C3D20E22 -86.95 5.81 -9.6 -1.17 0
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144604 53388066 1 NF3O7C18H24 AB3C7D18E24 -425.86 6.98 -9.97 -0.55 0
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144605 53388067 1 NF3O6C18H26 AB3C6D18E26 -389.98 5.68 -9.99 -0.33 0
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144606 53388068 1 F3N4O10C27H35 A3B4C10D27E35 -548.68 4.83 -9.36 -1.21 0
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144607 53388069 2 N2O5C12H20 A2B5C12D20 -466.28 3.22 -9.68 -0.67 0
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144608 53388070 1 NC16H17 AB16C17 84.87 2.34 -8.68 -0.43 0
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144609 53388071 1 NC16H17 AB16C17 82.46 2.25 -8.69 -0.43 0
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144610 53388072 1 NC18H19 AB18C19 82.99 2.06 -8.69 -0.4 0
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144611 53388073 1 NC17H17 AB17C17 89.81 2.12 -8.68 -0.43 0
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144612 53388074 1 NH13C15 AB13C15 121.45 2.15 -8.71 -0.49 0
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144613 53388075 1 NOH15C19 ABC15D19 97.71 1.39 -8.92 -0.7 0
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144614 53388076 2 NOH6C9 ABC6D9 126.78 7.63 -9.13 -1.7 0
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144615 53388077 1 NH17C23 AB17C23 138.67 1.28 -8.09 -0.54 0
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144616 53388078 1 NH19C24 AB19C24 128.03 1.88 -8.05 -0.64 0
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144617 53388079 1 SiN3O10C32H49 AB3C10D32E49 -473.93 4.68 -9.14 -1.03 0
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144618 53388080 1 SiN3O12C53H67 AB3C12D53E67 -471.25 8.12 -8.47 -0.78 0
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144619 53388081 1 SiN3O10C47H57 AB3C10D47E57 -369.05 7.41 -8.66 -0.92 0
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144620 53388082 1 ClN2H19C22 AB2C19D22 72.37 2.56 -8.17 -0.6 0
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144621 53388083 1 ClNH18C19 ABC18D19 43.57 1.5 -9.18 -0.81 0
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144622 53388084 1 BrNH20C21 ABC20D21 54.23 1.83 -9.3 -0.81 0
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144623 53388085 1 BrClO6H24C27 ABC6D24E27 -156.8 3.83 -9.44 -0.46 0
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144624 53388086 1 ClO7H27C28 AB7C27D28 -203.67 3.86 -9.06 -0.54 0
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144625 53388761 1 NSiO5C36H61 ABC5D36E61 -287.36 1.06 -8.77 0.09 0
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144626 53388762 1 NSiO5C29H53 ABC5D29E53 -307.35 3.68 -8.63 -0.33 0
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144627 53389149 2 ON3C5H6 AB3C5D6 -19.41 1.31 -9.09 -0.52 0
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144628 53389254 1 N2F3O4H29C34 A2B3C4D29E34 -242.65 8.19 -8.45 -0.95 0
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144629 53389385 1 OF3N5H12C19 AB3C5D12E19 -66.69 6.02 -9.27 -1.57 0
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144630 53389812 1 ClON3H16C17 ABC3D16E17 32.87 2.52 -8.27 -0.91 2
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144631 53390002 1 NZnS2O4C13H23 ABC2D4E13F23 -180.25 9.4 -8.1 -1.06 0
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144632 53390387 1 ON8H24C25 AB8C24D25 99.81 5.91 -8.29 -0.91 0
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144633 53390388 1 O2N4C27H28 A2B4C27D28 3.92 4.81 -8.26 -0.75 0
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144634 53390389 1 O2N7C28H29 A2B7C28D29 34.97 2.69 -8.31 -0.79 0
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144635 53390470 1 SiO7N8C45H54 AB7C8D45E54 -229.85 3.49 -8.42 -0.58 0
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144636 53390497 1 SCl2N4O4C22H22 AB2C4D4E22F22 -83.2 3.44 -9.49 -1.39 0
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144637 53390498 1 FSCl2N4O4H21C25 ABC2D4E4F21G25 -121.01 5.29 -9.09 -1.54 0
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144638 53390757 1 O4N5C31H35 A4B5C31D35 -125.32 7.29 -8.62 -0.12 0
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144639 53390959 1 SiF2O6N8C46H56 AB2C6D8E46F56 -325.97 2.84 -8.46 -0.55 0
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144640 53391371 1 N5O5C31H37 A5B5C31D37 -175.76 12.46 -8.79 -0.31 0
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144641 53391623 1 N3H11C16 A3B11C16 116.85 5.25 -8.7 -0.99 0
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144642 53392058 1 FNO4H8C12 ABC4D8E12 -168.17 8.19 -9.41 -1.65 0
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144643 53392059 1 N2H10C15 A2B10C15 126.51 4.83 -8.42 -0.64 0
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144644 53392526 1 NO3C27H27 AB3C27D27 -38.92 3.88 -7.76 -0.22 0
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144645 53392729 1 O3C14H16 A3B14C16 -113.85 3.81 -9.82 -0.09 0
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144646 53392730 1 NO6C22H35 AB6C22D35 -213.72 1.85 -8.22 0.2 0
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144647 53392731 1 NSiO3C17H33 ABC3D17E33 -223.29 2.15 -8.71 1.13 0
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144648 53392732 2 NOH9C12 ABC9D12 37.01 3.47 -9.53 -1.49 0