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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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409304 135082084 1 OS2C7H14 AB2C7D14 -66.27 4.21 -8.63 0.25 0
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409305 135082085 1 CrSO3H6C11 ABC3D6E11 26.63 0.63 -7.87 -0.82 0
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409306 135082086 1 SiO4C15H26 AB4C15D26 -222.57 3.44 -8.3 0.88 0
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409307 135082087 1 O3C14H14 A3B14C14 -87.61 5.65 -9.46 -1.49 0
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409308 135082088 1 O5C14H14 A5B14C14 -167.58 3.79 -9.44 -1.43 0
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409309 135082089 1 FNOC13H16 ABCD13E16 -55.67 2.77 -8.62 0.1 -3
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409310 135082090 9 C4H5 A4B5 203.98 3.16 0.0 0.0 0
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409311 135082091 4 C3H4 A3B4 34.78 1.45 -8.75 0.63 0
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409312 135082092 1 TiCl2H28C40 AB2C28D40 294.18 6.26 -8.16 -1.46 0
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409313 135082093 4 H7C10 A7B10 259.55 2.0 -5.64 -3.9 0
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409314 135082094 1 TiCl2H32C38 AB2C32D38 87.51 4.38 -6.99 -1.26 0
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409315 135082095 2 H16C19 A16B19 126.55 1.26 -8.28 -0.72 0
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409317 135082097 1 SN2O4H8C9 AB2C4D8E9 -113.49 4.4 -10.34 -0.91 0
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409318 135082098 1 OC11H16 AB11C16 -36.23 1.92 -8.71 0.22 0
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409319 135082099 1 OC11H16 AB11C16 -40.06 1.6 -8.82 0.28 0
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409320 135082100 2 NO2H8C10 AB2C8D10 -52.02 4.79 -9.17 -1.91 0
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409321 135082101 1 ON4C36H48 AB4C36D48 100.75 3.81 -7.72 -0.76 0
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409322 135082102 1 PtSBr2C10H18 ABC2D10E18 70.47 5.91 -9.23 -3.05 0
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409323 135082103 1 PtSI2C10H18 ABC2D10E18 89.55 4.24 -9.2 -3.41 0
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409324 135082104 1 ClPtSnN2O4C23H29 ABCD2E4F23G29 -36.17 17.05 -8.09 -2.0 0
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409325 135082105 1 ClGePtN2O4C23H29 ABCD2E4F23G29 -72.94 9.55 -7.54 -1.55 0
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409326 135082106 1 BOSi2C13H29 ABC2D13E29 -153.39 1.41 -8.9 1.08 0
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409327 135082107 1 BC9H15 AB9C15 -24.5 0.36 -8.48 0.85 0
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409328 135082108 2 BNC7H14 ABC7D14 -93.68 0.2 -7.83 1.99 0
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409329 135082109 2 BNC9H18 ABC9D18 -116.58 0.51 -7.81 1.94 1
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409330 135082110 1 OK2C10H16 AB2C10D16 -50.14 12.14 -5.43 0.37 0
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409331 135082111 1 OC10H17 AB10C17 -44.65 1.92 0.0 0.0 1
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409332 135082112 1 KC6H11 AB6C11 10.35 9.42 -5.34 0.27 1
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409333 135082113 1 KC7H13 AB7C13 6.35 9.28 -5.32 0.29 1
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409334 135082114 1 KC8H15 AB8C15 1.84 9.31 -5.33 0.28 0
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409335 135082115 1 KH3F6C8 AB3C6D8 -328.98 4.64 -8.04 0.28 0
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409336 135082116 1 OK2F3H5C8 AB2C3D5E8 -221.34 12.16 -6.67 0.49 1
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409337 135082117 1 KO2C10H11 AB2C10D11 -63.74 8.32 -6.07 -0.14 0
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409338 135082118 1 O2C10H11 A2B10C11 -34.04 2.86 0.0 0.0 1
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409339 135082119 1 KO3C11H13 AB3C11D13 -106.81 8.5 -6.22 -0.12 0
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409340 135082120 1 O3C11H13 A3B11C13 -71.32 2.9 0.0 0.0 1
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409341 135082121 1 KC4H7 AB4C7 20.48 9.35 -5.25 0.31 0
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409342 135082122 1 SeC2H2P2 AB2C2D2 100.88 2.4 -8.86 -1.13 1
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409343 135082123 1 NOSC2H2 ABCD2E2 -13.47 0.29 0.0 0.0 1
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409344 135082124 1 NC2H2O2 AB2C2D2 -11.38 0.71 0.0 0.0 1
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409345 135082125 1 OSC3H3 ABC3D3 -18.0 2.22 0.0 0.0 1
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409346 135082126 1 AsS2H4C6 AB2C4D6 42.9 0.54 0.0 0.0 1
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409347 135082127 1 SbS2H4C6 AB2C4D6 32.6 0.05 0.0 0.0 0
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409348 135082128 1 SH4N4C7 AB4C4D7 97.46 1.06 -8.79 -1.5 0
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409349 135082129 1 N2O3C10H18 A2B3C10D18 -116.67 2.45 -8.9 0.5 0
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409350 135082130 1 BrN2C10H13 AB2C10D13 16.4 2.58 -8.44 -0.36 0
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409351 135082131 1 O5H12C17 A5B12C17 -118.77 4.3 -9.82 -0.98 0
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409353 135082133 1 N3O5C23H30 A3B5C23D30 -83.03 2.6 0.0 0.0 0
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409355 135082135 1 N4O8C33H35 A4B8C33D35 -199.93 4.9 0.0 0.0 0
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409356 135082136 1 LiOC10H15 ABC10D15 -82.04 5.46 -7.41 2.46 0
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409357 135082137 1 OC10H16 AB10C16 -66.63 1.38 -8.56 1.46 0
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409360 135082140 1 LiOC10H15 ABC10D15 -84.72 5.39 -7.67 2.58 0
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409361 135082141 1 OC10H16 AB10C16 -64.36 2.6 -8.8 1.46 0
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409362 135082142 1 LiOC10H15 ABC10D15 -82.69 5.47 -7.65 2.55 0
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409363 135082143 1 OC10H16 AB10C16 -64.52 0.77 -8.9 1.36 0
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409364 135082144 1 OSN2H14C16 ABC2D14E16 39.09 1.77 -8.27 -0.73 0
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409365 135082145 1 ON2C23H24 AB2C23D24 40.04 1.96 -8.9 -0.18 1
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409366 135082146 1 N3C35H48 A3B35C48 56.49 2.76 0.0 0.0 1
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409367 135082147 1 N3C36H50 A3B36C50 49.26 3.46 0.0 0.0 0
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409368 135082148 1 NO2C15H17 AB2C15D17 -56.77 5.87 -8.56 -0.27 0
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409369 135082150 2 SiC30H42 AB30C42 113.42 0.3 -8.34 -1.06 0
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409370 135082151 2 Si2C44H63 A2B44C63 206.3 0.33 -8.35 -1.1 0
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409371 135082152 2 Si3C58H84 A3B58C84 238.23 0.23 -8.3 -1.23 0
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409372 135082153 2 Si4C72H105 A4B72C105 327.68 0.13 -8.25 -1.31 0
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409373 135082154 2 Si5C86H126 A5B86C126 351.98 0.39 -8.2 -1.34 -1
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409374 135082155 1 PO3H11F15C21 AB3C11D15E21 -877.38 8.42 0.0 0.0 -1
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409375 135082156 1 PO4F12H18C27 AB4C12D18E27 -700.54 14.17 0.0 0.0 -1
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409376 135082157 1 ClPO3F12H15C26 ABC3D12E15F26 -695.96 4.64 0.0 0.0 -1
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409377 135082158 1 PO3F12H24C38 AB3C12D24E38 -616.0 1.55 0.0 0.0 -1
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409378 135082159 1 PO3F15H19C33 AB3C15D19E33 -830.86 10.2 0.0 0.0 -1
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409379 135082160 1 PO4F12H26C39 AB4C12D26E39 -682.44 8.13 0.0 0.0 -1
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409381 135082162 1 PO3F15H15C27 AB3C15D15E27 -863.95 3.92 0.0 0.0 -1
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409382 135082163 1 PO4F12H22C33 AB4C12D22E33 -721.33 3.23 0.0 0.0 -1
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409383 135082164 1 ClPO3F12H19C32 ABC3D12E19F32 -656.31 8.61 0.0 0.0 -1
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409385 135082166 1 PO5F12H28C40 AB5C12D28E40 -594.28 5.92 0.0 0.0 -1
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409386 135082167 1 PCl2O3F12H22C38 AB2C3D12E22F38 -629.27 8.54 0.0 0.0 -1
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409387 135082168 1 PO4F12H12C25 AB4C12D12E25 -708.37 4.94 0.0 0.0 -1
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409388 135082169 1 PO3F12H16C26 AB3C12D16E26 -565.2 10.65 0.0 0.0 -1
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409389 135082170 1 PO4F12H22C33 AB4C12D22E33 -700.97 7.26 0.0 0.0 -1
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409391 135082172 1 BrMgSN2O2C5H7 ABCD2E2F5G7 -84.03 3.47 -7.46 -1.81 0
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409392 135082173 1 SN2O2C5H8 AB2C2D5E8 -83.93 7.66 -9.43 -0.6 0
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409393 135082174 1 SBr2Mg2N2O4C6H6 AB2C2D2E4F6G6 -289.01 6.23 -9.38 -1.02 0
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409394 135082175 1 SN2O4C6H8 AB2C4D6E8 -163.72 4.35 -10.13 -1.4 0
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409395 135082176 2 SO2C7H9 AB2C7D9 -162.73 2.01 -8.92 -0.92 0
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409396 135082177 1 NOLi2C12H15 ABC2D12E15 -58.96 1.66 -8.14 1.33 0
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409397 135082178 1 NOLi3H14C22 ABC3D14E22 50.36 15.96 -7.31 0.88 0
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409398 135082179 1 ClNO2C11H12 ABC2D11E12 -36.0 4.44 -9.1 -0.36 0
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409399 135082180 1 ClNO6C11H12 ABC6D11E12 -5.47 9.07 -9.54 -2.9 0
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409400 135082181 1 O4N5C10H15 A4B5C10D15 -85.04 4.16 -9.8 -0.91 0
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409401 135082182 2 GaO2C9H13 AB2C9D13 -145.84 3.96 -8.27 -0.22 0
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409402 135082183 1 GaO2C9H13 AB2C9D13 -79.06 3.65 -8.54 -0.18 0
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409403 135082184 2 GaO2C11H17 AB2C11D17 -159.8 4.55 -7.79 0.18 0
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409404 135082185 1 GaO2C11H17 AB2C11D17 -78.2 3.53 -8.24 0.15 0
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409405 135082186 2 AlO2C10H15 AB2C10D15 -231.09 5.94 -8.94 0.03 0
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409409 135082190 1 O5C24H38 A5B24C38 -152.79 3.52 -7.94 0.18 0
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409410 135082191 1 Li2H4N4C7 A2B4C4D7 84.87 14.24 -7.7 0.75 0
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409411 135082192 2 ON3C8H9 AB3C8D9 26.31 6.23 -9.54 -0.58 0
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409412 135082193 1 NSF2O6C16H29 ABC2D6E16F29 -367.16 4.61 -9.02 -0.02 0
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409413 135082194 1 FO3N5C11H14 AB3C5D11E14 -109.46 12.82 -9.15 -0.17 1
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409414 135082195 1 N2O2C4H9 A2B2C4D9 -1.15 4.47 0.0 0.0 0