List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
338420 127259112 1 N2O3C10H14 A2B3C10D14 -112.23 3.51 -9.73 -0.09 0
338421 127259113 1 SO2N3C8H11 AB2C3D8E11 -58.88 2.83 -8.8 -0.39 0
338422 127259114 1 SO2N3C7H9 AB2C3D7E9 -51.49 2.23 -8.99 -0.46 0
338423 127259115 1 BrClNO3H7C9 ABCD3E7F9 -110.5 6.34 -9.38 -0.83 0
338424 127259116 1 BrClN2O2H8C9 ABC2D2E8F9 -31.98 2.5 -8.86 -0.66 0
338425 127259117 1 BrO2N3H10C11 AB2C3D10E11 1.99 4.66 -8.79 -0.5 0
338426 127259118 1 BrSO2C9H9 ABC2D9E9 -65.88 2.82 -8.93 -0.55 0
338427 127259119 1 ClNSO6H8C9 ABCD6E8F9 -143.19 9.03 -10.73 -2.01 0
338428 127259120 1 ClNO3H14C16 ABC3D14E16 -85.78 3.76 -8.69 -0.38 0
338429 127259121 1 ClNO3C14H16 ABC3D14E16 -122.51 6.69 -8.55 -0.15 0
338430 127259122 1 ClNO3C10H10 ABC3D10E10 -113.73 2.67 -9.28 -0.57 0
338431 127259123 1 ClSO3C9H9 ABC3D9E9 -98.38 4.84 -8.83 -0.66 0
338432 127259124 1 ClNSO2H12C17 ABCD2E12F17 -13.95 1.47 -8.73 -1.12 0
338433 127259125 1 NO3C11H11 AB3C11D11 -82.14 4.87 -10.04 -0.79 0
338434 127259126 1 SO4C12H14 AB4C12D14 -139.3 5.42 -10.06 -0.7 0
338435 127259127 1 NO4C12H15 AB4C12D15 -139.43 3.44 -8.21 -0.48 0
338436 127259128 1 FNO3H8C9 ABC3D8E9 -154.54 4.98 -9.29 -0.52 0
338437 127259129 1 SeN2O3H12C13 AB2C3D12E13 -53.43 5.58 -8.85 -0.69 0
338438 127259130 2 SO2C8H8 AB2C8D8 -132.61 1.85 -8.53 -0.44 0
338439 127259131 1 INO3H8C9 ABC3D8E9 -91.35 5.03 -9.16 -0.94 0
338440 127259132 1 SO3H12C13 AB3C12D13 -86.95 3.56 -8.32 -0.55 0
338441 127259133 1 NSO3C13H17 ABC3D13E17 -105.39 4.83 -8.37 -0.53 0
338442 127259134 1 NO3C12H13 AB3C12D13 -69.5 5.28 -8.89 -0.42 0
338443 127259135 1 NO3C13H17 AB3C13D17 -98.54 2.89 -8.5 -0.09 0
338444 127259136 1 NO3C11H13 AB3C11D13 -87.2 2.93 -8.57 -0.11 0
338445 127259137 1 O5H12C13 A5B12C13 -186.03 6.87 -9.36 -0.93 0
338446 127259138 2 SO2C11H12 AB2C11D12 -106.18 6.27 -8.84 -0.78 0
338447 127259139 1 SO5C14H14 AB5C14D14 -155.77 4.69 -9.55 -0.53 0
338448 127259140 1 N2O5H8C9 A2B5C8D9 -113.35 8.76 -9.98 -1.49 0
338449 127259141 1 NSO5C12H15 ABC5D12E15 -118.12 5.41 -9.1 -1.64 0
338450 127259142 1 NSO6H13C15 ABC6D13E15 -115.99 4.14 -9.9 -2.01 0
338451 127259143 1 NSO4C11H13 ABC4D11E13 -93.02 3.89 -9.56 -1.67 0
338452 127259144 1 N3O4H9C10 A3B4C9D10 -55.86 2.89 -9.88 -1.43 0
338453 127259145 1 SO4H14C15 AB4C14D15 -97.82 5.21 -8.6 -0.46 0
338454 127259146 1 N2O3H16C18 A2B3C16D18 -39.64 5.3 -9.23 -0.96 0
338455 127259147 1 SO2N3H11C12 AB2C3D11E12 20.68 1.36 -8.74 -0.75 0
338456 127259148 1 O5H10C13 A5B10C13 -146.48 7.5 -9.53 -1.67 0
338457 127259149 1 NI2O3H11C13 AB2C3D11E13 -46.18 4.0 -8.86 -1.15 0
338458 127259150 1 O6C15H16 A6B15C16 -208.82 3.07 -8.78 -0.19 0
338459 127259151 1 SO2N4C6H10 AB2C4D6E10 -41.22 2.71 -8.61 0.06 0
338460 127259152 1 SO2N3C11H13 AB2C3D11E13 -48.86 4.11 -8.1 -0.19 0
338461 127259153 1 ClFNSO2C9H9 ABCDE2F9G9 -120.58 3.55 -8.65 -0.63 0
338462 127259154 1 FSN2O4C13H15 ABC2D4E13F15 -137.08 6.38 -9.25 -1.27 0
338463 127259155 1 ClNO4H10C11 ABC4D10E11 -96.99 2.69 -9.37 -0.99 0
338464 127259156 1 ClNSO3H8C10 ABCD3E8F10 -77.52 2.64 -9.55 -1.29 0
338465 127259157 1 ClN2O5C9H9 AB2C5D9E9 -111.81 3.57 -9.98 -1.77 0
338466 127259158 1 ClINO3C15H15 ABCD3E15F15 -87.54 3.77 -8.82 -1.18 0
338467 127259159 1 INCl2O3H10C13 ABC2D3E10F13 -79.09 3.04 -9.03 -1.29 0
338468 127259160 1 ClINO3C23H31 ABCD3E23F31 -123.55 4.13 -8.71 -1.08 0
338469 127259161 1 ClINO3H11C13 ABCD3E11F13 -71.56 4.03 -8.81 -1.15 0