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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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192532 78282126 1 N2S3O4H12C17 A2B3C4D12E17 -24.94 4.53 -9.06 -1.73 1
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192533 78282601 1 N2O3C18H29 A2B3C18D29 -143.2 5.25 0.0 0.0 0
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192534 78282647 2 NO3C9H12 AB3C9D12 -229.1 6.29 -8.88 -0.38 0
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192535 78282835 1 N4O5H20C23 A4B5C20D23 -69.51 8.79 -9.01 -1.49 0
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192536 78283043 1 NO4C21H25 AB4C21D25 -143.6 2.93 -8.64 -0.64 0
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192537 78283244 2 OSN2H6C8 ABC2D6E8 56.86 3.89 -9.42 -1.52 0
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192538 78283996 1 NO6H19C24 AB6C19D24 -145.92 4.48 -8.6 -1.21 0
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192539 78283997 1 ClSN2O5C20H23 ABC2D5E20F23 -178.96 3.64 -9.52 -0.78 0
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192540 78283998 1 BrFSN2O5C19H20 ABCD2E5F19G20 -207.81 5.38 -9.33 -0.8 0
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192541 78284003 1 SN2O5C23H30 AB2C5D23E30 -190.21 2.04 -9.42 -0.82 0
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192542 78284022 1 SCl2N2O5C19H20 AB2C2D5E19F20 -179.56 6.79 -9.54 -0.72 1
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192543 78284130 1 BrN2O3C18H28 AB2C3D18E28 -95.99 4.88 0.0 0.0 0
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192544 78284155 1 FSCl2O2N3H16C20 ABC2D2E3F16G20 -52.39 4.69 -9.2 -1.67 0
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192545 78284368 1 N2O5C20H22 A2B5C20D22 -104.02 5.03 -8.81 -1.62 0
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192546 78284661 2 NO2C6H7 AB2C6D7 -87.12 8.54 -9.42 -1.08 0
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192547 78284672 1 NO4C16H17 AB4C16D17 -125.56 5.56 -9.0 -0.85 0
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192548 78284828 1 NO3Cl4H11C13 AB3C4D11E13 -121.85 2.94 -9.12 -0.77 1
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192549 78284902 1 ClN3O5H15C19 AB3C5D15E19 -111.49 2.26 0.0 0.0 0
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192550 78285132 1 ClOSN5H16C17 ABCD5E16F17 53.82 7.23 -9.24 -0.89 0
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192551 78285133 1 SO2N3C20H21 AB2C3D20E21 12.39 2.51 -8.61 -0.41 0
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192552 78285134 1 O2N3H15C18 A2B3C15D18 25.29 6.91 -8.87 -1.3 0
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192553 78285135 1 FO2N3H12C17 AB2C3D12E17 -11.95 6.1 -8.98 -1.46 0
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192554 78285244 1 N2O3C18H20 A2B3C18D20 -91.03 5.36 -8.89 -0.89 0
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192555 78285302 1 NF2O3H13C16 AB2C3D13E16 -175.16 2.72 -9.13 -1.16 0
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192556 78285540 1 NO5C23H25 AB5C23D25 -206.82 4.01 -9.22 -1.19 0
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192557 78285649 1 ClSO2N4C18H23 ABC2D4E18F23 -45.67 2.92 -9.03 -0.43 0
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192558 78286332 1 SO4N5C20H27 AB4C5D20E27 -128.33 2.89 -9.03 -0.72 0
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192559 78286339 1 BrN2O3C15H17 AB2C3D15E17 -88.14 5.41 -10.39 -1.44 0
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192560 78286405 1 N2O5C17H22 A2B5C17D22 -172.71 8.26 -9.39 -1.06 0
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192561 78286439 1 ClN2O3C20H25 AB2C3D20E25 -115.97 7.39 -9.68 -0.49 0
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192562 78286532 1 N2O3C17H18 A2B3C17D18 -66.81 3.75 -8.57 -0.16 2
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192563 78286793 1 O3N4C21H30 A3B4C21D30 -80.13 12.8 -8.28 0.17 1
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192564 78286794 1 O3N4C21H29 A3B4C21D29 -91.76 6.69 0.0 0.0 1
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192565 78286795 1 O3N4C22H33 A3B4C22D33 -107.9 9.83 0.0 0.0 0
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192566 78286796 1 O3N4C22H32 A3B4C22D32 -111.12 3.15 -8.62 -0.28 1
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192567 78286797 1 SN3O3C17H24 AB3C3D17E24 -85.5 14.57 0.0 0.0 0
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192568 78286798 1 SN3O3C17H23 AB3C3D17E23 -75.91 3.48 -8.81 -1.45 1
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192569 78286799 1 ClOSN3C20H23 ABCD3E20F23 31.02 14.95 0.0 0.0 0
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192570 78286800 1 ClOSN3C20H22 ABCD3E20F22 35.96 3.57 -8.88 -1.4 1
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192571 78286880 1 SN3O3C22H28 AB3C3D22E28 -54.08 7.33 0.0 0.0 1
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192572 78286881 1 SCl2N3O3C20H22 AB2C3D3E20F22 -52.99 10.5 0.0 0.0 0
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192573 78286882 1 SCl2N3O3C20H21 AB2C3D3E20F21 -68.33 5.23 -9.15 -0.95 1
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192574 78287071 1 N3O5C19H24 A3B5C19D24 -65.89 9.7 0.0 0.0 1
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192575 78287175 1 N2F3O3C19H22 A2B3C3D19E22 -196.02 8.93 0.0 0.0 1
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192576 78287176 1 N3O3C20H24 A3B3C20D24 -30.81 12.44 0.0 0.0 0
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192577 78287177 1 N3O3C20H23 A3B3C20D23 -47.14 7.44 -8.7 -0.52 0
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192578 78287178 1 N3O5C21H23 A3B5C21D23 -41.31 8.64 -8.65 -1.66 0
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192579 78287320 1 BrSO2N4C20H25 ABC2D4E20F25 -4.16 3.51 -9.15 -0.57 0
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192580 78287434 2 NO2C7H11 AB2C7D11 -197.24 2.87 -9.44 -0.41 0
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192581 78287435 1 N2O4C19H32 A2B4C19D32 -212.17 5.18 -9.05 0.02 0