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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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184520 77171972 1 O2N3C21H33 A2B3C21D33 -98.04 2.28 -9.14 0.1 0
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184521 77171973 1 SO4N5C29H45 AB4C5D29E45 -188.81 3.83 -8.68 0.02 0
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184522 77171974 1 ClSO3N5C20H26 ABC3D5E20F26 -119.6 2.03 -8.98 -0.94 0
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184523 77172133 1 ClFN2O2C18H26 ABC2D2E18F26 -170.55 9.57 -9.54 -0.24 1
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184524 77172920 1 O5N7C22H24 A5B7C22D24 -13.28 8.49 0.0 0.0 0
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184525 77172921 1 OSCl2F3N4H15C20 ABC2D3E4F15G20 -110.63 5.22 -8.86 -1.15 0
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184526 77172922 1 ClO4N5C25H28 AB4C5D25E28 -84.85 9.07 -9.24 -0.95 0
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184527 77172976 1 BrO3C12H15 AB3C12D15 -118.3 5.6 -8.76 -0.31 0
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184528 77173363 1 N2O2C21H32 A2B2C21D32 -109.03 6.06 -8.47 -0.32 0
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184529 77173445 1 N3O4C22H35 A3B4C22D35 -203.77 3.96 -9.38 0.24 0
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184530 77173446 1 N2O3C17H28 A2B3C17D28 -149.48 3.66 -9.08 0.37 0
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184531 77173447 1 NC9H17 AB9C17 -27.89 1.88 -8.9 3.15 0
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184532 77173448 1 OCl2N2C15H26 AB2C2D15E26 -123.49 4.24 -9.16 0.0 0
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184533 77173588 1 SO5C20H20 AB5C20D20 -150.76 8.17 -8.78 -1.45 0
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184534 77173966 1 NOC19H29 ABC19D29 -2.34 1.92 -8.47 0.25 0
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184535 77174088 1 N2O3C23H34 A2B3C23D34 -89.77 5.37 -8.0 0.17 0
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184536 77174206 1 O2F3N7C16H20 A2B3C7D16E20 -179.19 6.55 -8.86 -0.4 0
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184537 77174257 1 NO2C19H27 AB2C19D27 -86.32 1.37 -8.39 -0.14 0
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184538 77174598 1 BNSO2C4H6 ABCD2E4F6 -128.52 2.71 -9.57 -0.6 0
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184539 77174799 1 BrN2O2F3H6C11 AB2C2D3E6F11 -176.66 3.66 -9.52 -1.49 0
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184540 77174800 1 SN2O2C12H16 AB2C2D12E16 -71.37 4.02 -8.88 -0.95 0
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184541 77174801 1 BrSC11H17 ABC11D17 -2.19 2.16 -9.28 -0.33 0
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184542 77174802 1 NOC10H11 ABC10D11 7.28 1.46 -8.21 -0.29 0
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184543 77174803 1 ClSN2O3H15C17 ABC2D3E15F17 -70.61 3.45 -8.65 -1.14 0
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184544 77174804 1 SN2O3H14C17 AB2C3D14E17 -34.91 5.43 -8.46 -1.06 0