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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228033 87563255 1 NOC15H21 ABC15D21 -44.49 4.36 -8.14 0.34 0
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228034 87563256 1 O4F6N8H32C35 A4B6C8D32E35 -302.06 13.21 -9.02 -1.58 0
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228035 87563258 1 N3O4H17C20 A3B4C17D20 -66.91 9.31 -8.58 -1.24 0
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228036 87563259 1 SO5C6H8 AB5C6D8 -175.14 6.32 -11.3 -0.7 0
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228037 87563260 1 O3N4H20C27 A3B4C20D27 79.89 2.86 -9.03 -1.23 0
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228038 87563261 1 BrINO2C21H35 ABCD2E21F35 -17.98 83.46 -4.39 -4.39 1
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228039 87563262 1 INO2C21H35 ABC2D21E35 -103.06 7.29 0.0 0.0 0
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228040 87563263 1 N2O4F6H18C21 A2B4C6D18E21 -362.84 6.55 -9.96 -1.52 0
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228041 87563264 1 N2O4F6H18C21 A2B4C6D18E21 -363.13 7.83 -9.92 -1.47 0
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228042 87563266 1 BrPO2C4H8 ABC2D4E8 -86.91 2.03 -10.02 -0.97 0
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228043 87563274 2 NOC6H13 ABC6D13 -112.1 6.91 -9.55 0.92 0
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228044 87563276 1 O2N5C24H25 A2B5C24D25 94.29 6.32 -8.92 -1.06 0
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228045 87563279 1 NO3C15H17 AB3C15D17 -39.91 3.83 -8.68 -0.85 0
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228046 87563280 1 ClN2O4C12H15 AB2C4D12E15 -142.53 0.88 -9.1 -1.09 0
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228047 87563281 1 CPO2N3H6 ABC2D3E6 -56.45 3.93 -9.4 0.43 0
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228048 87563282 4 OC7H13 AB7C13 -265.73 1.35 -10.8 -0.78 0
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228049 87563283 1 BrFN3O4H13C14 ABC3D4E13F14 -67.71 6.03 -9.85 -2.08 0
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228050 87563284 4 OC7H13 AB7C13 -267.96 2.53 -10.84 -1.02 0
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228051 87563286 1 O2C7H10 A2B7C10 -32.15 3.19 -9.13 0.99 0
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228052 87563287 1 NO3C9H11 AB3C9D11 -35.94 4.1 -8.17 -0.42 0
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228053 87563288 1 ClN2O2C11H13 AB2C2D11E13 -62.81 2.67 -8.76 -0.86 0
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228054 87563289 2 OC12H12 AB12C12 -8.75 0.26 -8.73 0.14 0
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228055 87563290 1 N3O5H19C20 A3B5C19D20 -85.72 6.17 -8.91 -1.08 0
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228056 87563291 1 N3O5H19C20 A3B5C19D20 -87.08 6.43 -8.57 -1.26 0
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228057 87563292 1 FePO2S2C4H10 ABC2D2E4F10 -204.95 5.63 0.0 0.0 0
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228058 87563295 1 N3O5C11H13 A3B5C11D13 -142.8 6.18 -9.56 -0.66 0
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228059 87563298 1 SiO2C15H29 AB2C15D29 -139.08 1.04 0.0 0.0 0
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228060 87563302 1 PO3C20H41 AB3C20D41 -248.39 2.5 -9.59 0.7 0
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228061 87563303 1 ClOC10H11 ABC10D11 -18.6 3.9 -9.45 -0.74 0
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228062 87563304 1 SN2O8C12H26 AB2C8D12E26 -270.33 10.77 -7.62 -1.29 0
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228063 87563308 1 ClN2O5C28H45 AB2C5D28E45 -251.35 5.14 -8.27 0.31 0
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228064 87563309 2 O3C14H20 A3B14C20 -279.99 2.05 -9.67 -1.06 0
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228065 87563311 1 OC16H34 AB16C34 -123.72 1.51 -9.4 2.38 0
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228066 87563312 1 O2F4N4H24C27 A2B4C4D24E27 -179.62 3.7 -9.59 -0.94 0
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228067 87563313 1 O2F4N4H24C27 A2B4C4D24E27 -188.76 7.73 -9.3 -0.85 0
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228068 87563314 2 OF3N3C6H6 AB3C3D6E6 -293.1 9.64 -9.83 -1.48 0
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228071 87563319 1 ON5C12H15 AB5C12D15 61.83 4.56 -8.84 -1.35 0
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228072 87563330 1 F3O3N5C30H30 A3B3C5D30E30 -166.56 8.64 -9.31 -0.88 0
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228073 87563334 1 ClF3O3N4H24C27 AB3C3D4E24F27 -165.42 7.78 -9.13 -0.76 0
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228074 87563336 1 PdSN2O4C16H34 ABC2D4E16F34 5.21 3.55 -5.34 -2.25 0
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228075 87563338 1 O3C30H50 A3B30C50 -207.5 1.89 -9.66 0.4 0
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228076 87563343 1 ClSO2F3N3H11C15 ABC2D3E3F11G15 -190.52 3.8 -9.5 -1.78 0
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228077 87563344 1 SO2F3N3H10C15 AB2C3D3E10F15 -153.44 5.31 -9.22 -1.78 0
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228078 87563345 1 ClSF3N3O3H11C15 ABC3D3E3F11G15 -228.16 8.5 -9.94 -1.69 0
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228079 87563347 1 ClOSF3N3H11C14 ABCD3E3F11G14 -145.39 8.38 -8.7 -1.34 0
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228080 87563348 1 OSF3N3H10C14 ABC3D3E10F14 -114.33 3.86 -8.51 -1.6 0
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228081 87563349 1 NS2F3O5H6C13 AB2C3D5E6F13 -217.07 3.79 -9.13 -1.96 0
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228082 87563350 1 O4N5H15C18 A4B5C15D18 -76.31 7.62 -9.43 -1.52 0
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228083 87563352 1 NSO4F8H13C15 ABC4D8E13F15 -548.53 4.55 -10.03 -1.46 -1
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228084 87563361 1 N2O2C5H9 A2B2C5D9 -52.6 2.6 0.0 0.0 0