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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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438082 135227653 1 IN3C15H24 AB3C15D24 35.86 1.58 -8.1 -0.83 0
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438083 135227654 1 SN2C11H26 AB2C11D26 -55.16 3.02 -8.5 0.66 -1
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438084 135227655 1 SN4O4H5C8 AB4C4D5E8 -37.14 3.73 0.0 0.0 0
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438085 135227656 1 SN4O4H6C8 AB4C4D6E8 -55.95 1.99 -9.38 -1.98 0
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438086 135227657 1 ION4C14H15 ABC4D14E15 80.95 4.22 -8.43 -1.32 0
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438087 135227658 1 ION4C13H13 ABC4D13E13 76.38 4.93 -8.63 -1.27 0
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438088 135227659 1 O2N3C22H23 A2B3C22D23 25.71 3.97 -8.45 -0.33 0
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438089 135227660 1 NSO5C8H9 ABC5D8E9 -180.8 6.08 -10.38 -1.64 0
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438090 135227661 1 FN4H17C19 AB4C17D19 66.83 3.86 -8.34 -0.4 0
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438091 135227662 1 O2N3C21H21 A2B3C21D21 30.75 3.3 -8.24 -0.2 0
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438092 135227663 1 SF3O3N7H16C17 AB3C3D7E16F17 -158.98 5.79 -9.16 -2.0 0
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438093 135227664 1 ClIN4H14C19 ABC4D14E19 153.47 4.05 -8.5 -1.19 0
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438094 135227665 1 ClIN4H12C13 ABC4D12E13 108.33 5.28 -9.01 -1.38 0
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438095 135227666 1 ClIN3H15C19 ABC3D15E19 105.94 4.52 -8.34 -1.21 0
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438096 135227667 1 FN3H20C21 AB3C20D21 51.96 3.84 -8.87 -0.35 0
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438097 135227668 1 FIN4H10C13 ABC4D10E13 97.6 3.0 -8.97 -0.97 0
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438098 135227669 1 ION4H17C20 ABC4D17E20 125.55 5.54 -8.46 -0.95 0
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438099 135227670 1 ION3H18C20 ABC3D18E20 73.22 4.14 -7.89 -0.9 0
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438100 135227671 1 FON3H18C20 ABC3D18E20 25.27 5.28 -8.73 -0.35 0
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438101 135227672 1 ON3F4H15C20 AB3C4D15E20 -139.32 1.45 -9.05 -0.81 0
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438102 135227673 1 FSN3H18C20 ABC3D18E20 62.39 5.0 -8.74 -0.39 0
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438103 135227674 1 FON3H18C20 ABC3D18E20 25.44 2.4 -8.44 -0.29 0
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438104 135227675 1 FON3H16C20 ABC3D16E20 40.6 5.38 -8.91 -0.94 0
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438105 135227676 1 FON4H19C20 ABC4D19E20 40.57 3.78 -8.41 -0.4 0
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438106 135227677 1 F2N3H17C20 A2B3C17D20 14.67 5.03 -8.74 -0.56 0
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438107 135227678 1 FIN3H11C13 ABC3D11E13 58.57 3.64 -9.02 -1.2 0
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438108 135227679 1 FON3H16C19 ABC3D16E19 49.49 7.15 -8.3 -1.58 0
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438109 135227680 1 FON3H22C23 ABC3D22E23 35.91 2.78 -8.73 -0.16 0
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438110 135227681 2 NC5H5 AB5C5 93.0 2.28 -8.66 -0.18 0
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438111 135227682 1 NOC6H13 ABC6D13 -44.8 3.66 -8.48 0.99 0
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438112 135227683 1 ON5C20H21 AB5C20D21 84.38 4.15 -7.91 -0.35 0
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438113 135227684 1 ON4C20H20 AB4C20D20 74.56 3.61 -7.99 -0.62 0
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438114 135227685 1 FON4H17C20 ABC4D17E20 121.29 5.41 -8.48 -1.79 0
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438115 135227686 1 FN4H17C20 AB4C17D20 89.84 3.76 -9.0 -0.8 0
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438116 135227687 1 FON5H18C21 ABC5D18E21 77.1 5.2 -9.11 -0.86 0
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438117 135227688 2 NOC5H12 ABC5D12 -140.92 4.11 -9.1 1.7 0
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438118 135227689 1 FON4H17C21 ABC4D17E21 61.13 5.46 -8.79 -0.52 0
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438119 135227690 1 FON3C22H22 ABC3D22E22 9.33 2.47 -9.03 -0.52 0
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438120 135227691 1 F2N4H16C19 A2B4C16D19 35.34 2.42 -9.0 -0.65 0
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438121 135227692 1 N3F4H15C20 A3B4C15D20 -92.21 2.49 -9.02 -1.02 0
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438122 135227693 1 F2N3H15C19 A2B3C15D19 18.79 4.39 -8.87 -0.58 0
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438123 135227694 1 FON3H18C20 ABC3D18E20 19.93 5.8 -8.79 -0.76 0
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438124 135227695 1 FN3H18C20 AB3C18D20 57.18 5.18 -8.84 -0.51 0
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438125 135227696 1 IOPC6H6 ABCD6E6 -1.63 1.7 -9.03 -0.69 0
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438126 135227701 1 ClFN4H16C19 ABC4D16E19 72.64 2.52 -9.03 -0.69 0
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438127 135227729 1 N2O4C21H34 A2B4C21D34 -214.56 3.21 -9.6 0.03 0
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438128 135227751 1 BrN3H16C25 AB3C16D25 148.85 2.0 -9.11 -1.33 0
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438129 135227752 1 BrN3H22C33 AB3C22D33 179.54 2.06 -9.21 -1.35 0
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438130 135227753 1 BrSN3H18C31 ABC3D18E31 178.19 2.58 -8.68 -1.41 0
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438131 135227754 1 BrN3H22C33 AB3C22D33 179.14 1.89 -9.25 -1.31 0