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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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442639 135253523 1 S2N3H25C43 A2B3C25D43 226.67 2.06 -8.62 -1.17 0
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442640 135253525 1 SN3H27C43 AB3C27D43 220.64 1.17 -8.64 -1.14 0
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442641 135253527 1 SN3H33C56 AB3C33D56 283.21 1.16 -8.54 -1.27 0
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442642 135253528 1 ON2H24C41 AB2C24D41 164.85 3.97 -8.11 -1.24 0
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442643 135253532 1 ON3H27C43 AB3C27D43 186.12 1.11 -8.67 -1.08 0
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442644 135253579 1 ON4C27H28 AB4C27D28 47.7 6.0 -8.35 -0.35 0
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442645 135253624 1 O2N4H20C25 A2B4C20D25 56.18 3.78 -8.7 -0.6 0
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442646 135253628 1 ClOC8H11 ABC8D11 -44.41 2.11 -9.16 0.05 1
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442647 135253632 1 OPC26H26 ABC26D26 51.9 7.42 0.0 0.0 1
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442648 135253633 1 OPC26H26 ABC26D26 48.23 7.53 0.0 0.0 0
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442649 135253634 1 ClO2H9C11 AB2C9D11 -19.34 2.25 -8.5 -0.8 0
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442650 135253636 1 ClO2C13H13 AB2C13D13 -32.29 2.4 -8.42 -0.77 0
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442651 135253641 2 O3C13H25 A3B13C25 -354.73 3.29 -10.14 0.96 0
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442652 135253642 1 O6C25H48 A6B25C48 -348.87 3.2 -10.13 0.94 0
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442653 135253646 1 O7C31H40 A7B31C40 -267.92 4.66 -8.85 -0.27 0
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442654 135253647 1 P2N6O27C58H102 A2B6C27D58E102 -1346.91 11.25 -9.64 0.27 0
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442655 135253649 1 PF3N5O7C32H45 AB3C5D7E32F45 -437.75 3.73 -9.0 -0.08 0
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442656 135253794 1 FOSN4H11C14 ABCD4E11F14 36.41 3.31 -8.53 -1.46 0
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442657 135253846 1 NC14H27 AB14C27 -31.28 1.01 -8.1 1.48 0
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442658 135253976 2 ClNOH12C16 ABCD12E16 21.97 8.35 -8.41 -0.94 0
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442659 135254061 1 BrON2C24H29 ABC2D24E29 28.0 3.33 -8.63 -0.28 0
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442660 135254089 1 ON2C5H8 AB2C5D8 30.49 1.61 -9.21 -1.25 0
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442661 135254161 1 O3N4H36C41 A3B4C36D41 43.12 6.18 -8.33 -0.37 0
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442662 135254210 1 SF3O5C25H27 AB3C5D25E27 -339.3 4.65 -8.65 -1.26 0
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442663 135254325 1 ON6C23H30 AB6C23D30 52.72 6.55 -8.59 -0.22 0
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442664 135254385 1 NC10H17 AB10C17 22.21 1.83 -9.23 0.34 0
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442665 135254497 1 ON2C13H14 AB2C13D14 -9.71 2.6 -9.27 -0.82 0
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442666 135254588 1 ON5C25H31 AB5C25D31 62.12 4.61 -8.78 -0.33 0
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442667 135254683 1 ClNOF2H22C26 ABCD2E22F26 -32.56 2.95 -9.03 -0.71 0
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442668 135254705 1 BrNOH22C24 ABCD22E24 55.54 1.97 -9.04 -0.64 0
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442669 135254954 1 N2C21H38 A2B21C38 -52.15 2.27 -8.13 2.95 0
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442670 135255225 1 ClN3O5C21H26 AB3C5D21E26 -150.56 4.06 -9.23 -0.73 0
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442671 135255436 1 ClON6C30H37 ABC6D30E37 23.91 4.97 -8.39 -0.37 0
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442672 135255729 1 ClON7C29H38 ABC7D29E38 24.14 6.2 -8.59 -0.59 0
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442673 135255731 1 ClON6C26H31 ABC6D26E31 28.28 5.03 -8.59 -0.55 0
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442674 135255735 1 ClON6C24H27 ABC6D24E27 48.96 3.13 -8.46 -0.32 0
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442675 135255736 1 ClON6C25H29 ABC6D25E29 37.81 5.94 -8.6 -0.68 0
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442676 135255738 1 ClON6C28H35 ABC6D28E35 13.9 5.52 -8.42 -0.43 0
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442677 135255739 1 ClON7C26H32 ABC7D26E32 48.74 8.22 -8.47 -0.62 0
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442678 135255740 1 ClON9C29H34 ABC9D29E34 75.81 9.78 -8.27 -0.76 0
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442679 135255741 1 ClO2N6C24H27 AB2C6D24E27 43.27 7.45 -8.83 -1.0 0
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442680 135255742 1 ClN6C26H33 AB6C26D33 68.25 2.98 -8.49 -0.51 0
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442681 135255743 1 ClON6C26H31 ABC6D26E31 24.98 4.82 -8.51 -0.5 0
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442682 135255744 1 ClON8C26H27 ABC8D26E27 83.38 2.48 -8.32 -0.84 0
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442683 135255746 1 ClON8C29H39 ABC8D29E39 40.62 4.11 -8.47 -0.52 0
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442684 135255748 1 ON6C28H36 AB6C28D36 24.81 3.34 -8.46 -0.39 0
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442685 135255749 1 ClFON6C25H28 ABCD6E25F28 -9.43 4.02 -8.56 -0.56 0
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442686 135255750 1 ClON6C24H29 ABC6D24E29 3.74 4.14 -8.66 -0.68 0
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442687 135255752 1 ClON6C25H29 ABC6D25E29 30.74 5.02 -8.6 -0.59 0
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442688 135255770 1 BrFO3N5H15C20 ABC3D5E15F20 -12.09 3.47 -8.43 -0.87 0
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442689 135255774 1 BrFO3N5H13C17 ABC3D5E13F17 16.19 3.84 -8.75 -1.9 0
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442690 135255782 1 BrFO3N7C13H15 ABC3D7E13F15 36.4 3.22 -9.02 -2.27 0
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442691 135255788 2 N3H20C34 A3B20C34 454.37 2.63 -8.03 -0.87 0
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442692 135255819 1 NS3Cl7H18C20 AB3C7D18E20 14.62 0.52 -9.07 -2.39 0
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442693 135255822 1 N3O4C13H21 A3B4C13D21 -149.79 2.76 -9.15 -0.74 0
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442694 135255826 1 N4C13H32 A4B13C32 -35.95 3.98 -8.85 2.96 0
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442695 135255827 1 ON5C10H13 AB5C10D13 69.2 3.86 -9.62 -0.59 0
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442696 135255828 2 O5C17H19 A5B17C19 -387.4 0.66 -8.72 -0.62 0
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442697 135255829 1 SO6C21H22 AB6C21D22 -197.16 6.06 -9.17 -0.74 0
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442698 135255830 1 ClSN2O2C14H15 ABC2D2E14F15 -38.09 6.21 -8.92 -1.14 0
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442699 135255831 2 NF2O2C10H12 AB2C2D10E12 -332.61 4.67 -9.94 -0.77 0
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442700 135255832 1 O4F6C15H26 A4B6C15D26 -546.16 2.43 -10.42 1.06 0
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442701 135255835 1 OC20H38 AB20C38 -133.32 2.14 -9.72 3.11 0
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442702 135255836 2 O3N4C20H24 A3B4C20D24 -88.72 3.24 -8.6 -1.18 0
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442703 135255838 2 OH23C40 AB23C40 280.59 1.9 -8.28 -1.05 0
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442704 135255839 1 N2O3F6C18H20 A2B3C6D18E20 -433.14 6.02 -10.21 -1.06 0
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442705 135255905 2 ON2C6H8 AB2C6D8 -6.78 3.47 -9.93 -0.62 0
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442706 135255906 1 FO2N7H22C23 AB2C7D22E23 2.51 4.48 -9.3 -0.93 0
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442707 135255913 1 ON8C24H24 AB8C24D24 127.58 11.2 -9.24 -0.87 0
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442708 135255916 1 FO2N8H23C25 AB2C8D23E25 33.5 3.48 -9.45 -1.12 0
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442709 135255917 1 FO3N8H23C26 AB3C8D23E26 2.22 7.59 -9.51 -1.13 0
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442710 135255919 1 O2N4C13H20 A2B4C13D20 -31.35 1.63 -9.49 0.05 0
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442711 135255920 1 ON2C12H14 AB2C12D14 0.71 2.86 -9.83 -0.33 0
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442712 135255921 1 O2N8H24C25 A2B8C24D25 73.01 12.82 -9.12 -1.02 0
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442713 135255922 2 OH29C48 AB29C48 339.83 1.59 -8.23 -1.08 0