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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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184195 77126442 1 SN4C11H14 AB4C11D14 86.18 2.36 -8.38 -0.94 0
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184196 77126443 1 BrN2O3C14H15 AB2C3D14E15 -108.19 5.72 -8.86 -1.1 0
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184197 77126444 1 FO2N5C12H12 AB2C5D12E12 23.47 4.43 -8.2 -1.48 0
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184198 77126445 1 N2O2C11H14 A2B2C11D14 -32.68 3.08 -8.7 0.07 0
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184199 77126446 1 O2N3C14H21 A2B3C14D21 -28.99 1.9 -8.39 0.35 0
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184200 77126447 1 SO2N3C14H19 AB2C3D14E19 -64.53 5.73 -8.6 -0.11 0
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184201 77126452 1 O2N3C16H25 A2B3C16D25 -41.03 2.83 -8.53 0.2 0
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184202 77126521 1 N2O3C16H16 A2B3C16D16 -26.84 2.53 -8.82 -0.31 0
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184203 77126656 1 SN2O4H12C13 AB2C4D12E13 -88.59 2.98 -9.4 -1.39 0
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184204 77126657 1 SO4N5C9H11 AB4C5D9E11 -104.58 7.13 -9.99 -1.41 0
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184205 77126872 1 O4N5C24H29 A4B5C24D29 -90.96 7.06 -8.95 -0.22 0
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184206 77126896 1 N2O5C23H26 A2B5C23D26 -166.22 3.82 -8.78 -0.02 0
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184207 77126901 1 ClN2O4C22H23 AB2C4D22E23 -136.79 1.4 -8.68 -0.39 0
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184208 77126902 1 F3O4N5H22C24 A3B4C5D22E24 -228.93 2.6 -8.87 -0.76 0
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184209 77127063 1 SN3O3C13H19 AB3C3D13E19 -114.75 10.4 -9.68 -0.74 0
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184210 77127064 1 FSN3O3C12H16 ABC3D3E12F16 -152.38 6.4 -10.02 -1.1 0
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184211 77127065 1 ClSN3O3C12H16 ABC3D3E12F16 -113.14 8.08 -9.84 -1.2 1
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184212 77127151 1 ClO2N8H14C18 AB2C8D14E18 103.5 8.51 0.0 0.0 0
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184213 77128016 1 ClFNO2H7C8 ABCD2E7F8 -114.24 2.19 -10.12 -0.98 0
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184214 77128017 1 NSO3C8H9 ABC3D8E9 -104.09 4.06 -8.88 -0.65 0
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184215 77128018 1 NO2F3H6C8 AB2C3D6E8 -193.28 4.5 -10.15 -1.3 0
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184216 77128252 1 NOF4C9H9 ABC4D9E9 -226.12 4.19 -9.48 -0.43 0
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184217 77128363 1 ClNOF3C10H11 ABCD3E10F11 -214.05 2.6 -9.18 -0.34 0
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184218 77128454 1 NF3O4H8C10 AB3C4D8E10 -301.4 6.08 -11.16 -1.7 0
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184219 77128497 1 NF3O4C11H12 AB3C4D11E12 -314.24 5.48 -9.22 -0.78 0
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184220 77128527 1 ClNF6H6C9 ABC6D6E9 -309.56 1.43 -10.33 -1.17 0
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184221 77129060 1 NF3O4H8C9 AB3C4D8E9 -303.09 3.5 -9.53 -0.81 0
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184222 77129553 1 NO3C16H17 AB3C16D17 -81.33 4.0 -9.23 -0.24 0
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184223 77129554 1 ClNO2F4H6C9 ABC2D4E6F9 -269.33 3.93 -10.29 -1.65 0
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184224 77129765 1 ClFNO4H15C16 ABCD4E15F16 -160.64 5.18 -8.63 -0.7 0
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184225 77130281 1 BrON2C8H11 ABC2D8E11 -22.07 4.56 -8.75 -0.15 0
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184226 77130609 2 NOC8H13 ABC8D13 -82.04 3.17 -8.72 0.23 0
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184227 77130610 2 NOC8H13 ABC8D13 -82.48 3.53 -8.85 0.23 0
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184228 77130611 1 NOF3H14C15 ABC3D14E15 -164.36 3.91 -9.56 -0.78 0
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184229 77130612 1 NO5C14H19 AB5C14D19 -185.46 5.0 -8.83 -0.65 0
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184230 77130613 1 OCl2N2C13H18 AB2C2D13E18 -47.89 2.9 -8.38 -0.22 0
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184231 77130614 1 BrFN2O4C8H8 ABC2D4E8F8 -114.24 12.9 -9.05 -0.76 0
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184232 77130620 1 N2O3C14H22 A2B3C14D22 -105.0 1.67 -8.83 0.13 0
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184233 77130876 1 N2O2C11H18 A2B2C11D18 -58.82 3.11 -8.11 0.3 0
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184234 77130980 1 ClFON2C8H10 ABCD2E8F10 -74.68 3.42 -9.23 -0.49 0
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184235 77131114 1 N3O4C9H11 A3B4C9D11 -59.5 9.03 -10.0 -1.88 0
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184236 77131276 1 ON2F4C9H10 AB2C4D9E10 -226.16 4.36 -9.46 -1.0 0
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184237 77131277 1 FON3C12H18 ABC3D12E18 -60.13 3.61 -8.47 -0.09 0
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184238 77131898 1 N2O4C11H14 A2B4C11D14 -80.29 8.34 -9.36 -0.99 0
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184239 77132408 1 SN4O4C22H22 AB4C4D22E22 -28.72 9.97 -8.98 -1.9 0
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184240 77132409 1 ClSO4N5C24H26 ABC4D5E24F26 -61.67 4.18 -9.18 -2.13 0
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184241 77132410 1 SO4N5C24H25 AB4C5D24E25 -21.32 7.56 -8.97 -1.86 0
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184242 77132411 1 N5O7C26H27 A5B7C26D27 -158.18 4.89 -8.85 -1.76 0
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184243 77132412 1 ClN5O5H14C16 AB5C5D14E16 -184.45 3.29 -9.38 -1.44 1
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184244 77132984 1 N2O4C32H53 A2B4C32D53 -198.98 4.02 0.0 0.0 0