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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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38003 8026326 1 BrClO3H12C15 ABC3D12E15 -75.86 3.43 -9.06 -0.49 0
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38004 8026328 1 O2N4H14C19 A2B4C14D19 18.68 4.79 -8.85 -1.52 0
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38005 8026342 1 BrOSN2H9C13 ABCD2E9F13 33.51 2.66 -9.23 -1.11 1
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38006 8026345 1 O3N4H23C24 A3B4C23D24 -6.84 8.8 0.0 0.0 0
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38007 8026346 1 O3N4H22C24 A3B4C22D24 -19.02 7.07 -8.68 -0.88 1
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38008 8026354 1 FO3N4C23H26 AB3C4D23E26 -108.87 13.36 0.0 0.0 0
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38009 8026362 1 S2O3N4C15H18 A2B3C4D15E18 -52.33 6.29 -8.71 -0.67 0
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38010 8026363 1 S2O3N4C15H18 A2B3C4D15E18 -52.51 7.08 -8.81 -0.65 0
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38011 8026364 1 SO2N3C19H21 AB2C3D19E21 -54.78 3.18 -9.1 -0.66 0
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38012 8026366 2 ON3C10H11 AB3C10D11 51.59 6.34 -8.96 -0.24 0
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38013 8026394 1 SO2N4C22H24 AB2C4D22E24 31.01 3.29 -8.86 -0.53 0
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38014 8026401 1 OSN6H14C17 ABC6D14E17 88.79 1.57 -8.78 -1.32 0
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38015 8026405 1 ClN3O3C22H22 AB3C3D22E22 -21.65 3.49 -8.87 -1.3 0
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38016 8026412 1 OSN4H20C23 ABC4D20E23 97.3 6.65 -8.81 -0.85 0
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38017 8026413 1 NSO4C19H21 ABC4D19E21 -105.58 6.05 -8.86 -0.59 0
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38018 8026421 1 FSO3N4H19C20 ABC3D4E19F20 -106.81 8.06 -9.44 -0.79 0
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38019 8026424 1 FO3N5H18C19 AB3C5D18E19 -79.14 4.04 -8.53 -0.62 0
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38020 8026436 1 SO3N4H16C21 AB3C4D16E21 21.16 9.8 -9.01 -1.33 0
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38021 8026444 1 NOSC21H21 ABCD21E21 3.51 4.35 -9.0 -0.57 0
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38022 8026445 1 NOSC21H21 ABCD21E21 3.53 4.29 -8.95 -0.53 0
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38023 8026446 1 FON2S2H17C18 ABC2D2E17F18 -16.36 4.15 -8.59 -0.69 0
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38024 8026471 1 O3N5C17H19 A3B5C17D19 -66.07 3.16 -9.16 -0.73 0
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38025 8026477 1 SF2N2O2H12C17 AB2C2D2E12F17 -64.21 3.7 -9.31 -1.24 0
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38026 8026482 1 ClNO4H16C19 ABC4D16E19 -115.42 8.97 -9.52 -0.98 0
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38027 8026483 1 ClNO4H16C19 ABC4D16E19 -117.41 5.12 -9.43 -0.92 0
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38028 8026491 1 N2O3C21H30 A2B3C21D30 -128.37 3.41 -8.13 0.17 0
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38029 8026492 1 N2O3C21H24 A2B3C21D24 -82.88 1.94 -8.24 0.02 0
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38030 8026494 1 SN2O4H16C17 AB2C4D16E17 -103.87 3.46 -8.82 -1.25 0
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38031 8026495 1 O3N6C18H20 A3B6C18D20 -18.47 5.27 -8.86 -0.49 0
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38032 8026505 1 N8H18C23 A8B18C23 228.35 2.4 -8.72 -1.15 0
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38033 8026508 1 SN2O2C15H18 AB2C2D15E18 -45.32 3.5 -8.7 -0.87 0
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38034 8026521 3 NOC7H11 ABC7D11 -116.37 3.0 -8.23 0.12 0
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38035 8026530 1 NOF3C17H20 ABC3D17E20 -196.49 4.11 -9.93 -0.76 0
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38036 8026532 1 N3O6C15H19 A3B6C15D19 -150.11 3.51 -9.54 -1.28 0
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38037 8026535 1 N2O4C23H30 A2B4C23D30 -127.14 2.59 -8.88 -0.4 0
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38038 8026541 1 O2N3C20H25 A2B3C20D25 -34.74 3.05 -8.64 -0.04 0
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38039 8026557 1 SO3N4C19H28 AB3C4D19E28 -97.23 4.28 -9.41 -0.05 0
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38040 8026561 1 SN4O5C16H22 AB4C5D16E22 -152.28 4.16 -9.22 -0.23 0
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38041 8026588 1 N2O3C18H26 A2B3C18D26 -96.46 2.95 -9.32 -0.59 0
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38042 8026591 1 O6H18C19 A6B18C19 -175.34 5.34 -9.06 -0.98 0
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38043 8026601 1 N2O3C22H28 A2B3C22D28 -103.22 5.45 -8.52 -0.98 0
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38044 8026604 1 SN2O4C20H26 AB2C4D20E26 -84.64 6.89 -9.0 -0.73 0
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38045 8026610 1 BrNO2H16C18 ABC2D16E18 -20.79 4.05 -9.23 -0.73 1
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38046 8026615 1 NSO3C20H22 ABC3D20E22 -53.73 5.69 0.0 0.0 0
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38047 8026622 1 N2S2O3C20H26 A2B2C3D20E26 -89.06 6.79 -9.0 -0.88 1
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38048 8026623 1 Cl2N2O3C21H21 A2B2C3D21E21 -71.9 4.56 0.0 0.0 1
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38049 8026624 1 NO4C22H24 AB4C22D24 -94.35 10.36 0.0 0.0 1
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38050 8026627 1 OCl2N2H21C22 AB2C2D21E22 26.44 5.84 0.0 0.0 0
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38051 8026650 1 N2F3O3H17C18 A2B3C3D17E18 -247.58 2.73 -8.98 -0.69 0
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38052 8026654 1 SN3O4C20H21 AB3C4D20E21 -84.59 3.91 -8.8 -1.39 0