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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
409190 135081969 1 KC9H9 AB9C9 41.41 10.85 -5.57 0.1 1
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409191 135081970 1 KH13C15 AB13C15 53.67 9.02 -5.65 0.03 0
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409192 135081971 1 H13C15 A13B15 78.57 0.08 0.0 0.0 1
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409193 135081972 1 KC4H7 AB4C7 15.24 9.09 -5.53 0.34 1
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409194 135081973 1 KC12H23 AB12C23 50.59 38.32 -3.24 -2.12 1
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409195 135081974 1 KC7H13 AB7C13 2.77 9.51 -5.47 0.25 0
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409196 135081975 1 C7H13 A7B13 4.32 0.56 0.0 0.0 1
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409197 135081976 1 KC10H17 AB10C17 16.17 10.22 -5.45 0.22 0
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409198 135081977 1 C10H17 A10B17 17.95 0.44 0.0 0.0 1
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409199 135081978 1 KOC9H9 ABC9D9 -21.23 8.45 -6.01 -0.12 0
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409200 135081979 1 TeC2H2P2 AB2C2D2 41.0 0.48 -8.73 -1.22 1
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409201 135081980 1 NOSC2H2 ABCD2E2 38.88 3.34 0.0 0.0 1
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409202 135081981 1 NOSC2H2 ABCD2E2 28.04 1.19 0.0 0.0 0
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409203 135081982 2 NH4C6 AB4C6 136.67 2.5 -8.43 -0.82 0
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409204 135081983 1 OC16H16 AB16C16 148.05 1.32 -8.26 0.06 0
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409206 135081985 1 O13C34H36 A13B34C36 -500.68 3.35 -8.88 -1.8 0
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409210 135081989 1 ClCuN2O6C21H22 ABC2D6E21F22 70.48 3.94 -8.12 -4.32 0
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409211 135081990 1 NO3C17H29 AB3C17D29 -172.79 4.23 -9.66 0.7 0
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409212 135081991 1 PC19H25 AB19C25 23.08 8.0 -6.76 0.61 0
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409213 135081992 1 FeNO3H5C6 ABC3D5E6 3.01 3.86 -8.42 -0.46 0
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409214 135081993 1 FePN2O2C21H22 ABC2D2E21F22 233.74 4.15 0.0 0.0 0
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409216 135081996 1 ZrC14H18 AB14C18 78.92 4.13 -7.72 -1.04 -1
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409217 135081997 1 ZrC19H26 AB19C26 40.5 6.7 -6.33 -1.2 -1
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409219 135081999 1 ZrC25H30 AB25C30 29.29 6.06 -6.74 -0.09 0
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409220 135082000 1 GeNOC20H35 ABCD20E35 -88.92 4.95 -7.4 0.69 0
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409221 135082001 1 GeNOC19H33 ABCD19E33 -75.62 4.89 -7.19 0.66 0
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409222 135082002 1 GeNOC18H31 ABCD18E31 -72.16 5.21 -7.44 0.66 0
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409223 135082003 1 GeNC25H33 ABC25D33 49.4 5.6 -7.22 -0.04 0
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409224 135082004 1 GeNC19H29 ABC19D29 59.81 0.49 -7.86 -1.18 0
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409225 135082005 1 GeNC21H37 ABC21D37 -2.18 2.0 -7.39 -1.0 0
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409226 135082006 1 GeNC21H37 ABC21D37 -6.23 5.28 -6.99 0.21 0
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409227 135082007 1 LiNOC10H22 ABCD10E22 40.0 16.72 -4.01 -0.33 0
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409228 135082008 1 NOC10H23 ABC10D23 -70.76 0.88 -8.76 2.04 0
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409229 135082009 1 LiNC8H14 ABC8D14 96.99 14.07 -3.98 -0.18 0
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409230 135082010 1 LiNC8H16 ABC8D16 37.75 8.95 -5.21 1.88 0
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409231 135082011 1 LiOC8H11 ABC8D11 -52.43 5.9 -7.5 1.72 0
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409232 135082012 1 LiOC13H21 ABC13D21 25.53 37.96 -4.58 -2.64 0
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409233 135082013 1 OC13H22 AB13C22 -55.49 2.31 -8.9 1.34 0
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409234 135082014 1 LiOC12H19 ABC12D19 -89.92 5.75 -7.39 2.58 0
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409235 135082015 1 OC12H20 AB12C20 -70.88 1.34 -8.54 1.46 0
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409236 135082016 1 LiOC9H13 ABC9D13 -67.41 5.54 -7.63 2.51 0
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409237 135082017 1 OC9H14 AB9C14 -46.95 0.61 -8.88 1.3 0
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409238 135082018 1 LiOC7H9 ABC7D9 -44.87 5.85 -7.7 2.41 0
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409239 135082019 1 LiOC9H13 ABC9D13 -54.61 5.77 -7.63 2.47 0
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409240 135082020 1 OC9H14 AB9C14 -34.31 0.69 -8.87 1.29 0
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409241 135082021 1 LiOC8H9 ABC8D9 3.33 7.95 -6.95 1.09 0
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409242 135082022 1 OC8H10 AB8C10 7.22 2.36 -8.93 0.82 0
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409243 135082023 1 LiOC8H13 ABC8D13 -80.74 5.58 -7.4 2.58 0
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409244 135082024 1 LiOC11H19 ABC11D19 -93.83 5.52 -7.3 2.67 0
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409245 135082025 1 OC11H20 AB11C20 -78.36 1.47 -8.48 1.54 0