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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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173637 75664083 1 ClO2S2N4H12C16 AB2C2D4E12F16 44.9 0.84 0.0 0.0 -1
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173638 75664084 1 S2N3O3C16H16 A2B3C3D16E16 -33.11 2.66 0.0 0.0 0
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173639 75664085 1 SN2O3C21H28 AB2C3D21E28 -101.13 4.75 -8.04 -0.67 0
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173640 75664086 1 N2F3O3H11C12 A2B3C3D11E12 -231.37 5.21 -9.85 -0.98 1
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173641 75664514 1 ClO2N3H17C22 AB2C3D17E22 3.69 5.82 0.0 0.0 1
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173642 75664515 1 OSN6H23C24 ABC6D23E24 117.85 8.7 0.0 0.0 -1
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173643 75664632 1 NSF4O4H14C20 ABC4D4E14F20 -252.71 6.06 0.0 0.0 0
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173644 75664645 2 NO2C13H13 AB2C13D13 -36.62 17.25 -8.73 -1.03 0
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173645 75665207 1 FSN3O4C20H22 ABC3D4E20F22 -175.69 1.47 -8.81 -0.56 1
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173646 75665381 1 ClN3O3C18H25 AB3C3D18E25 -87.61 6.01 0.0 0.0 -1
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173647 75665589 1 FN3O4H17C25 AB3C4D17E25 -17.42 5.54 0.0 0.0 -1
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173648 75666141 1 NO2C17H22 AB2C17D22 -35.09 3.83 0.0 0.0 0
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173649 75666142 1 NO2C17H23 AB2C17D23 -87.89 4.06 -9.28 0.4 0
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173650 75666409 1 N3O4C16H21 A3B4C16D21 -151.91 4.51 -9.72 -0.18 0
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173651 75666410 1 N3O3C18H25 A3B3C18D25 -134.78 4.05 -9.33 -0.11 0
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173652 75666769 1 O4N5C17H23 A4B5C17D23 -83.72 10.21 -9.66 -2.2 0
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173653 75666785 1 FSN2O3C20H21 ABC2D3E20F21 -137.89 5.43 -9.42 -1.37 0
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173654 75666843 1 SO3N4C19H24 AB3C4D19E24 -70.93 5.79 -9.16 -2.09 0
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173655 75666889 1 SO2N3C20H21 AB2C3D20E21 -13.83 2.71 -9.11 -2.03 0
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173656 75666895 1 N2O5C17H20 A2B5C17D20 -86.53 7.82 -9.34 -1.63 0
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173657 75666928 1 SO2N3C20H27 AB2C3D20E27 -78.03 7.61 -8.68 -0.35 0
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173658 75666929 1 SN3O3C19H23 AB3C3D19E23 -110.88 6.52 -8.84 -0.52 0
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173659 75666930 1 SN3O3C20H25 AB3C3D20E25 -118.76 7.46 -8.68 -0.37 0
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173660 75666931 1 NO4C21H23 AB4C21D23 -105.46 3.45 -8.56 -0.2 1
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173661 75666932 1 O4N5C19H26 A4B5C19D26 -119.17 6.18 0.0 0.0 1
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173662 75666933 1 N3O4C20H24 A3B4C20D24 -127.74 1.29 0.0 0.0 1
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173663 75666934 1 O3N6C20H25 A3B6C20D25 -64.06 3.08 0.0 0.0 0
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173664 75667209 2 NO2C10H15 AB2C10D15 -138.29 5.57 -8.48 -0.28 -1
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173665 75667552 1 N2O6H25C27 A2B6C25D27 -112.79 9.98 0.0 0.0 1
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173666 75667929 1 SN2O2C15H17 AB2C2D15E17 -61.9 3.34 0.0 0.0 1
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173667 75667930 1 ClN3O5H19C20 AB3C5D19E20 -105.0 2.22 0.0 0.0 1
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173668 75667931 1 ClN3O5H17C19 AB3C5D17E19 -99.2 0.89 0.0 0.0 1
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173669 75668000 1 BrOSN5C22H29 ABCD5E22F29 6.47 1.97 0.0 0.0 1
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173670 75668001 1 FOSN4C25H34 ABCD4E25F34 -70.17 3.78 0.0 0.0 1
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173671 75668002 1 O3N5C18H26 A3B5C18D26 -83.85 5.22 0.0 0.0 -1
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173672 75668003 1 SO2F3N5H11C13 AB2C3D5E11F13 -133.33 4.98 0.0 0.0 -1
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173673 75668004 1 N4O5C24H29 A4B5C24D29 -100.63 3.91 0.0 0.0 0
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173674 75668005 1 O3N5C22H27 A3B5C22D27 -26.27 14.34 -8.07 -1.36 1
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173675 75668006 1 O3N5C22H28 A3B5C22D28 -27.65 3.94 0.0 0.0 -1
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173676 75668007 1 S2O3N4H11C17 A2B3C4D11E17 59.1 8.79 0.0 0.0 -1
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173677 75668011 1 S2N3O3C19H24 A2B3C3D19E24 -73.53 7.49 0.0 0.0 0
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173678 75668073 1 ClF2N2O3H9C17 AB2C2D3E9F17 -96.35 6.24 -9.3 -1.57 -1
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173679 75668074 1 ClSN3O4H15C21 ABC3D4E15F21 -14.97 4.49 0.0 0.0 0
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173680 75668075 1 FO3N5C23H24 AB3C5D23E24 -43.17 14.38 -8.37 -0.76 1
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173681 75668214 1 SO2N5C18H24 AB2C5D18E24 -28.87 2.66 0.0 0.0 -1
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173682 75668215 1 S2N3O5H16C20 A2B3C5D16E20 -39.25 2.35 0.0 0.0 1
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173683 75668216 1 FSO2N5C24H33 ABC2D5E24F33 -94.84 1.93 0.0 0.0 -2
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173684 75669053 1 ClSN4O5H17C18 ABC4D5E17F18 -96.29 4.14 -9.21 -1.38 0
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173685 75669054 1 ClSN4O5C18H19 ABC4D5E18F19 -175.45 5.41 -8.85 -0.96 1
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173686 75669055 1 ON2C19H21 AB2C19D21 19.18 4.17 0.0 0.0 1