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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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234659 92303254 1 N3O3C22H29 A3B3C22D29 -68.59 7.15 -8.82 -0.01 0
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234660 92303258 1 F2O2N3C23H23 A2B2C3D23E23 -100.65 4.78 -9.32 -0.8 0
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234661 92303260 1 ClSO2N3C21H22 ABC2D3E21F22 -10.45 3.51 -9.22 -0.86 0
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234662 92303265 1 ClO2N4C19H25 AB2C4D19E25 -55.3 1.72 -9.22 -0.37 0
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234663 92303266 1 ClO2N4C19H25 AB2C4D19E25 -59.5 4.04 -9.06 -0.46 0
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234664 92303269 1 ClO2N3C21H26 AB2C3D21E26 -45.36 6.82 -9.29 -0.64 0
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234665 92303271 1 ClO2N3C21H28 AB2C3D21E28 -67.74 4.98 -9.24 -0.5 0
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234666 92303273 1 ClO2N4C21H29 AB2C4D21E29 -70.29 4.72 -9.3 -0.48 0
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234667 92303274 1 FN3O3C24H26 AB3C3D24E26 -101.54 1.89 -8.95 -0.28 0
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234668 92303278 1 O3N4C20H28 A3B4C20D28 -87.22 4.01 -8.92 -0.02 0
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234669 92303279 1 N3O3C22H31 A3B3C22D31 -99.85 4.89 -9.09 -0.14 0
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234670 92303281 2 ON2C11H16 AB2C11D16 -66.79 3.89 -9.15 -0.03 0
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234671 92303282 2 ON2C11H16 AB2C11D16 -69.2 7.28 -9.01 -0.11 0
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234672 92303283 1 Cl2O2N3C20H25 A2B2C3D20E25 -66.67 4.67 -9.27 -0.93 0
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234673 92303284 1 ClO2N3C24H26 AB2C3D24E26 -24.03 9.49 -9.18 -0.8 0
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234674 92303285 1 ClO2N3C24H26 AB2C3D24E26 -21.84 3.71 -8.99 -0.61 0
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234675 92303286 1 ClO2N3C20H24 AB2C3D20E24 -28.16 5.54 -9.32 -0.69 0
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234676 92303287 1 O3N4C21H30 A3B4C21D30 -95.24 6.58 -9.19 -0.3 0
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234677 92303288 1 O3N4C21H30 A3B4C21D30 -94.91 3.25 -9.08 -0.13 0
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234678 92303289 1 FN3O3C24H26 AB3C3D24E26 -96.13 6.84 -8.99 -0.21 0
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234679 92303290 1 FN3O3C24H26 AB3C3D24E26 -98.64 5.84 -9.03 -0.22 0
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234680 92303293 1 O2N3C22H29 A2B3C22D29 -44.02 0.98 -9.02 0.18 0
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234681 92303297 1 ClN3O3C22H24 AB3C3D22E24 -95.97 8.53 -9.38 -0.74 0
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234682 92303298 1 Cl2O2N3C20H23 A2B2C3D20E23 -35.84 4.31 -9.45 -0.8 0
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234683 92303301 1 O2N3C26H31 A2B3C26D31 -35.18 2.14 -9.1 0.08 0
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234684 92303303 1 O3N4C17H24 A3B4C17D24 -117.17 8.07 -9.4 -0.77 0
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234685 92303306 1 Cl2O2N3C20H23 A2B2C3D20E23 -42.08 4.31 -9.35 -0.89 0
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234686 92303308 2 FON2C10H13 ABC2D10E13 -144.18 2.01 -9.32 -0.73 0
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234687 92303309 1 N3O5C19H21 A3B5C19D21 -125.27 4.86 -9.26 -0.63 0
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234688 92303311 1 ON3C17H17 AB3C17D17 55.41 4.35 -9.4 -0.97 0
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234689 92303312 1 OH24C25 AB24C25 42.94 2.84 -9.05 -0.5 0
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234690 92303315 1 N3O4C20H23 A3B4C20D23 -93.11 5.47 -8.44 -0.08 0
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234691 92303316 1 SO2N4C20H26 AB2C4D20E26 -34.25 6.86 -9.03 -0.22 0
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234692 92303317 1 SN4C9H14 AB4C9D14 94.86 6.5 -8.44 -0.81 0
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234693 92303318 1 SO2N4C13H14 AB2C4D13E14 -2.79 6.33 -9.0 -0.7 0
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234694 92303319 1 SO2N4C13H14 AB2C4D13E14 -3.5 8.05 -9.03 -1.05 0
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234698 92303333 1 ClNO2C8H14 ABC2D8E14 -121.64 2.51 -10.14 0.17 0
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234699 92303338 1 Cl4O6H8C11 A4B6C8D11 -237.67 7.88 -10.25 -1.2 0
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234700 92303339 1 N2O2S2C9H12 A2B2C2D9E12 -59.04 8.25 -8.47 -0.95 0
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234702 92303343 1 SN3O3C16H29 AB3C3D16E29 -173.75 9.36 -9.13 0.01 0
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234703 92303346 1 NO7C13H15 AB7C13D15 -258.86 3.29 -10.51 -0.96 0
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234704 92303347 1 SN3O3C16H29 AB3C3D16E29 -160.25 5.29 -9.25 -0.14 1
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234705 92303348 1 PSN3O5C16H29 ABC3D5E16F29 -250.25 0.98 0.0 0.0 0
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234706 92303350 1 O3C12H14 A3B12C14 -86.15 2.63 -9.66 0.09 0
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234707 92303351 1 O3C12H14 A3B12C14 -90.05 2.83 -9.68 0.1 0
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234708 92303352 1 O3C12H14 A3B12C14 -85.94 1.39 -9.66 0.06 0
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234709 92303354 1 N3O4C15H15 A3B4C15D15 -100.18 6.92 -9.32 -1.0 0
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234710 92303355 1 SO3N5C12H15 AB3C5D12E15 -70.77 9.45 -9.3 -1.15 0
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234711 92303359 1 NO6C16H23 AB6C16D23 -252.65 4.37 -9.7 0.04 0
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234712 92303362 1 FNO8C14H20 ABC8D14E20 -425.09 1.68 -10.37 0.43 0