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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36451 8006994 1 ClSN3O4C18H18 ABC3D4E18F18 -116.99 2.96 -9.47 -0.88 0
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36452 8007025 1 ON7C15H19 AB7C15D19 24.89 4.95 -8.96 -0.59 0
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36453 8007027 1 ON7C15H19 AB7C15D19 27.92 4.08 -8.91 -0.6 0
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36454 8007041 2 ON3C8H11 AB3C8D11 -13.89 2.05 -8.4 0.1 1
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36455 8007042 1 ON4H17C18 AB4C17D18 77.29 4.1 0.0 0.0 0
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36456 8007054 1 O2F3N5C17H24 A2B3C5D17E24 -236.1 4.87 -8.97 -0.47 0
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36457 8007079 1 Cl2N3O3H15C19 A2B3C3D15E19 -69.27 7.77 -9.01 -1.65 0
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36458 8007087 1 SO2F3N5C17H20 AB2C3D5E17F20 -169.81 5.55 -8.92 -0.77 0
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36459 8007092 1 SN3O3H15C17 AB3C3D15E17 -2.45 4.72 -8.97 -1.99 1
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36460 8007109 1 N2O2C18H23 A2B2C18D23 -28.3 5.11 0.0 0.0 0
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36461 8007110 2 NOC9H11 ABC9D11 -44.3 3.89 -8.61 0.01 0
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36462 8007116 1 F2N2O3C18H20 A2B2C3D18E20 -182.2 4.02 -8.46 0.05 0
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36463 8007119 2 ClNOH7C8 ABCD7E8 -17.01 3.21 -8.67 -1.16 0
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36464 8007120 1 ClN2O2C16H17 AB2C2D16E17 -60.77 2.79 -8.9 -0.73 0
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36465 8007122 1 ClON4C15H15 ABC4D15E15 46.15 1.85 -8.41 -0.36 0
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36466 8007125 1 N2O3C17H18 A2B3C17D18 -73.75 1.59 -8.68 -0.42 0
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36467 8007150 1 F2O2N4H16C19 A2B2C4D16E19 -24.12 1.16 -8.34 -1.04 0
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36468 8007152 1 FO2N4C23H25 AB2C4D23E25 -11.91 8.95 -8.55 -0.73 0
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36469 8007173 1 O2F3N3H12C17 A2B3C3D12E17 -172.98 6.75 -9.14 -1.5 0
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36470 8007177 1 SN2O4H18C20 AB2C4D18E20 -41.28 5.4 -8.55 -0.57 0
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36471 8007179 1 SN2O5C19H22 AB2C5D19E22 -119.91 3.76 -8.29 -0.32 0
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36472 8007225 1 OSN4H18C19 ABC4D18E19 36.41 1.95 -8.96 -0.78 0
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36473 8007226 1 ClOS2N3H10C14 ABC2D3E10F14 45.69 4.82 -9.22 -1.76 0
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36475 8007245 1 OSF3N3H17C19 ABC3D3E17F19 -69.16 9.12 0.0 0.0 0
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36476 8007250 1 ON6H16C18 AB6C16D18 89.64 4.31 -8.76 -0.6 0
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36477 8007253 1 ClO2N4C20H23 AB2C4D20E23 -60.03 6.48 -7.98 -0.23 1
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36478 8007361 1 SO2N4C18H23 AB2C4D18E23 -7.1 6.92 0.0 0.0 0
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36479 8007363 1 N2O4C17H20 A2B4C17D20 -114.88 1.19 -9.1 -0.8 0
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36480 8007365 1 OSN4C17H22 ABC4D17E22 14.53 3.73 -8.73 -0.5 0
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36481 8007394 1 ClO3N4H15C17 AB3C4D15E17 31.38 6.37 -9.77 -1.16 0
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36482 8007410 1 ClSN2O3C19H19 ABC2D3E19F19 -72.04 9.26 -9.17 -1.84 0
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36483 8007413 1 NSF2O4H11C14 ABC2D4E11F14 -195.11 6.81 -9.58 -1.17 0
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36484 8007414 1 NSF2O4H11C14 ABC2D4E11F14 -198.86 6.13 -9.03 -1.24 -1
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36485 8007430 1 SCl2N2O4H11C17 AB2C2D4E11F17 -34.81 23.91 0.0 0.0 -1
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36486 8007432 1 SCl2N2O4H11C17 AB2C2D4E11F17 -71.71 4.34 0.0 0.0 0
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36487 8007445 1 N3O3C16H21 A3B3C16D21 -50.53 2.38 -8.42 -0.31 0
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36488 8007511 1 ClSN2O3C17H19 ABC2D3E17F19 -94.84 7.83 -9.84 -1.49 0
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36489 8007513 2 ON2C10H11 AB2C10D11 -31.66 4.86 -8.69 -0.32 1
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36490 8007515 1 S2N4O4C16H21 A2B4C4D16E21 -74.55 15.05 0.0 0.0 0
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36491 8007525 1 FOSN2C20H23 ABCD2E20F23 -59.48 5.25 -9.19 -0.92 0
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36492 8007531 1 N3O5C20H27 A3B5C20D27 -206.93 9.3 -9.36 -1.08 1
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36493 8007599 1 ClON4C13H20 ABC4D13E20 -3.05 3.94 0.0 0.0 1
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36494 8007614 1 N2C17H21 A2B17C21 46.77 1.34 0.0 0.0 0
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36495 8007642 1 ON5H17C22 AB5C17D22 112.9 3.87 -9.35 -1.36 0
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36496 8007644 1 N2O3H18C23 A2B3C18D23 -21.78 8.66 -8.22 -1.29 0
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36497 8007658 1 Cl2O2N3H11C13 A2B2C3D11E13 -7.6 7.09 -9.46 -1.47 0
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36498 8007659 1 N2O6C19H26 A2B6C19D26 -235.2 5.71 -8.46 -0.81 0
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36499 8007660 1 N2O6C19H26 A2B6C19D26 -236.11 6.56 -8.47 -0.75 0
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36500 8007700 1 ON2C16H22 AB2C16D22 5.89 3.74 -8.68 -0.15 0
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36501 8007702 1 O2S2N4C15H18 A2B2C4D15E18 -17.32 8.88 -8.8 -1.34 0