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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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406230 135076979 1 CrO6C13H14 AB6C13D14 -64.24 1.74 -7.2 0.21 0
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406231 135076980 1 CrOC8H14 ABC8D14 30.86 0.72 -7.35 0.81 0
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406232 135076981 1 CrO6H16C19 AB6C16D19 73.94 0.89 -7.16 -0.7 0
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406233 135076982 1 CrOC14H16 ABC14D16 19.77 1.89 -7.78 -0.82 0
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406234 135076983 1 NC10H19 AB10C19 0.82 3.69 -10.71 2.47 1
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406235 135076984 1 NO2C16H24 AB2C16D24 -52.33 1.36 0.0 0.0 0
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406236 135076985 1 N2O3C15H16 A2B3C15D16 -37.2 4.54 -9.17 -0.56 0
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406237 135076986 1 O3N5C20H23 A3B5C20D23 -17.61 9.04 -9.5 -1.29 0
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406238 135076987 1 N5O5C19H35 A5B5C19D35 -219.75 7.16 -9.81 -0.21 0
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406239 135076988 1 N5O5C28H35 A5B5C28D35 -141.79 6.74 -9.56 -0.44 0
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406240 135076989 1 N4O4C17H24 A4B4C17D24 -103.97 8.64 -8.56 -0.21 0
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406241 135076990 2 O3C14H22 A3B14C22 -345.71 10.94 -9.44 0.01 0
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406242 135076991 2 O3C7H11 A3B7C11 -280.72 1.56 -10.52 -0.29 0
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406243 135076992 1 BrNSO2C10H10 ABCD2E10F10 -52.0 1.73 -8.64 -0.87 0
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406244 135076993 1 S2O3C15H22 A2B3C15D22 -131.34 4.77 -8.83 -1.26 0
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406245 135076994 1 CrNSiO7C30H35 ABCD7E30F35 -144.29 4.88 -7.02 -0.29 0
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406246 135076995 1 CrNSiO2C25H35 ABCD2E25F35 57.13 0.65 -7.06 0.1 0
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406247 135076996 1 CrNO6C22H27 ABC6D22E27 -111.27 1.71 -6.68 0.71 0
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406248 135076997 1 CrNOC17H27 ABCD17E27 -38.91 3.04 -7.02 0.46 0
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406249 135076998 1 CrO8C17H22 AB8C17D22 -274.9 3.33 -7.76 0.11 0
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406250 135076999 1 CrO3C12H22 AB3C12D22 -139.15 2.07 -7.44 0.3 0
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406251 135077000 1 CrNO6C16H21 ABC6D16E21 -182.99 3.14 -8.13 0.03 0
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406252 135077001 1 CrNOC11H21 ABCD11E21 -91.19 6.26 -7.53 -0.19 0
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406253 135077002 1 CrO8C21H22 AB8C21D22 -227.97 4.74 -8.35 -0.43 0
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406254 135077003 1 CrO3C16H22 AB3C16D22 1.44 0.53 -6.92 0.18 0
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406255 135077004 1 CuLiOC14H28 ABCD14E28 106.14 11.38 -2.62 0.45 0
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406256 135077006 1 BrO5C13H15 AB5C13D15 -179.59 0.91 -9.68 -1.49 0
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406257 135077007 1 SSiBr2C9H12 ABC2D9E12 10.95 2.65 -9.1 -0.34 0
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406258 135077008 1 BrS2C18H27 AB2C18D27 -10.58 2.25 -8.64 -0.88 0
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406259 135077009 1 NO5H11C12 AB5C11D12 -80.75 8.19 -10.3 -1.82 0
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406260 135077049 1 FeO4C14H20 AB4C14D20 175.57 8.42 -5.5 -2.65 0
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406261 135077061 1 Cl2S3H22C34 A2B3C22D34 157.39 1.16 -8.47 -1.02 0
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406262 135077067 1 OWC7H8 ABC7D8 161.36 4.69 -6.18 0.7 0
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406263 135077071 1 LiC6H9 AB6C9 22.82 5.87 -7.51 3.41 1
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406264 135077073 1 NOC19H24 ABC19D24 4.59 2.16 0.0 0.0 0
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406265 135077080 1 CrSO2C12H22 ABC2D12E22 10.11 1.48 -6.24 0.69 0
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406266 135077083 1 NO3C9H13 AB3C9D13 -132.77 5.28 -9.92 0.23 0
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406267 135077093 1 SN2O4C17H18 AB2C4D17E18 -84.74 5.43 -8.73 -0.45 0
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406268 135077096 1 IN2O9C16H19 AB2C9D16E19 -373.2 5.44 -9.64 -1.5 0
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406269 135077107 1 IN2O6C19H27 AB2C6D19E27 -253.28 3.82 -8.96 -0.82 0
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406270 135077108 1 BrOSH13C14 ABCD13E14 15.09 4.13 -8.61 -0.62 0
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406271 135077109 1 OSC16H18 ABC16D18 -7.27 4.93 -8.34 -0.07 0
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406272 135077110 1 ClOSH13C14 ABCD13E14 2.92 4.14 -8.59 -0.58 0
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406273 135077111 1 BrO6H21C24 AB6C21D24 -181.29 2.7 -9.33 -0.7 0
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406274 135077112 1 SN2O4C22H24 AB2C4D22E24 -89.46 7.45 -8.64 -0.19 0
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406275 135077113 1 OH24C25 AB24C25 47.47 1.36 -9.35 0.12 0
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406276 135077114 1 SF3O5C22H31 AB3C5D22E31 -394.07 3.83 -9.52 -1.54 0
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406277 135077115 1 O2C9H14 A2B9C14 -71.31 7.33 -9.61 0.19 0
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406278 135077116 1 O7C16H26 A7B16C26 -333.74 1.8 -10.56 -0.53 0
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406279 135077117 2 NC6H7 AB6C7 51.09 4.81 -8.89 -0.12 0