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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387178 134984312 1 PC27H33 AB27C33 -9.17 1.35 -8.42 0.52 0
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387179 134984313 1 PO4H17C20 AB4C17D20 -141.4 4.89 -9.54 -1.12 0
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387180 134984314 1 SP2F3O3C38H62 AB2C3D3E38F62 -365.59 7.87 0.0 0.0 0
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387181 134984316 1 AlMoNPO3Cl4C19H32 ABCDE3F4G19H32 -307.08 7.62 0.0 0.0 0
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387182 134984319 1 ON2F4C6H10 AB2C4D6E10 -85.23 5.19 -10.39 0.78 0
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387183 134984320 1 BPF15H35C45 ABC15D35E45 -635.71 34.0 -8.53 -1.27 0
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387184 134984321 1 O3N6C8H14 A3B6C8D14 -13.81 10.53 -9.08 -1.77 0
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387185 134984322 1 O2N5C10H15 A2B5C10D15 -21.08 9.75 -9.67 -1.37 0
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387186 134984327 1 N3C18H31 A3B18C31 20.56 2.89 -8.33 -0.16 0
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387187 134984328 3 NC6H9 AB6C9 39.53 3.09 -8.22 0.01 0
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387188 134984329 1 N4O6H20C21 A4B6C20D21 -88.88 4.2 -9.06 -0.57 0
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387189 134984336 2 ON3C8H14 AB3C8D14 3.23 7.37 -9.18 -1.54 0
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387190 134984345 2 NOC8H9 ABC8D9 11.8 3.32 -8.85 0.06 0
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387191 134984350 2 NOC4H8 ABC4D8 -64.46 1.83 -9.47 -0.79 0
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387192 134984355 2 NC10H13 AB10C13 57.44 0.24 -8.92 0.29 0
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387193 134984357 1 H6N6C8O9 A6B6C8D9 -6.13 5.8 -10.87 -2.84 0
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387194 134984359 1 INPO3C31H31 ABCD3E31F31 -66.3 7.02 -7.96 -0.46 1
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387195 134984365 1 PC28H28 AB28C28 79.42 13.36 0.0 0.0 0
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387196 134984369 1 PO2C13H29 AB2C13D29 -197.3 3.63 -10.21 1.69 0
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387197 134984370 1 OPSC18H39 ABCD18E39 -178.74 2.99 -9.27 0.21 0
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387198 134984371 1 PS2C8H19 AB2C8D19 -99.24 3.76 -8.79 -0.13 0
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387199 134984376 1 P2F6C25H28 A2B6C25D28 -437.71 20.31 -9.93 -0.85 1
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387200 134984379 1 PC25H28 AB25C28 43.06 8.61 0.0 0.0 0
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387201 134984386 2 NO2C9H10 AB2C9D10 -110.67 4.11 -9.58 -0.63 0
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387202 134984395 1 N2O7C24H24 A2B7C24D24 -191.4 2.35 -9.41 -0.6 0
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387203 134984396 1 N2O7C27H30 A2B7C27D30 -204.36 2.97 -9.59 -0.82 0
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387204 134984408 1 FNP2O7C9H20 ABC2D7E9F20 -448.55 6.17 -10.56 -0.22 0
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387205 134984412 1 N2O3H22C24 A2B3C22D24 37.56 2.9 -8.85 -0.5 0
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387206 134984413 1 NPO7C13H26 ABC7D13E26 -325.73 6.32 -10.69 -0.38 0
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387207 134984414 1 N2O3C11H18 A2B3C11D18 -50.94 5.89 -10.38 -0.56 0
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387208 134984417 1 NO2C7H15 AB2C7D15 -49.62 4.78 -10.54 -0.2 0
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387209 134984422 2 NC7H13 AB7C13 -24.69 2.4 -8.67 2.4 0
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387210 134984423 1 NSO3C11H17 ABC3D11E17 -44.67 3.2 -8.9 -0.56 0
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387211 134984424 1 NO6C7H11 AB6C7D11 -188.58 2.5 -11.39 -0.98 0
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387212 134984428 1 OSN2Cl4H8C12 ABC2D4E8F12 -6.12 4.79 -8.98 -0.85 0
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387213 134984431 1 NOC16H17 ABC16D17 31.88 3.32 -9.17 0.01 0
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387214 134984433 1 NO7C19H27 AB7C19D27 -250.15 4.3 -9.03 -0.81 0
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387215 134984434 1 ClNO2C25H26 ABC2D25E26 11.16 2.45 -9.07 -0.51 0
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387216 134984441 1 NO2C16H17 AB2C16D17 -10.04 2.59 -8.56 0.0 0
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387217 134984442 1 MoPH4C6O6 ABC4D6E6 -33.18 6.39 0.0 0.0 0
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387218 134984459 2 NP2C27H44 AB2C27D44 -79.8 3.37 -7.03 0.42 0
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387219 134984460 1 CrPO5H9C12 ABC5D9E12 -196.49 3.35 -8.95 -0.33 -3
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387221 134984471 1 NbP2C8H19 AB2C8D19 26.62 2.22 -6.88 0.0 0
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387223 134984478 1 ClO3N4C19H33 AB3C4D19E33 -101.63 3.35 -8.51 -0.55 0
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387224 134984479 1 O4N5C10H17 A4B5C10D17 -66.8 5.26 -9.37 -1.78 0
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387225 134984480 1 FN3O3C18H18 AB3C3D18E18 -79.76 2.51 -9.23 -1.19 0
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387226 134984485 1 ON8C10H16 AB8C10D16 107.95 10.43 -9.06 -2.18 0
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387227 134984497 1 PSO2C20H25 ABC2D20E25 -101.69 7.7 -9.22 -0.99 0
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387228 134984504 1 ClN5H6C8O9 AB5C6D8E9 -13.89 3.87 -11.24 -2.63 0
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387229 134984505 1 Br2N4H6O7C8 A2B4C6D7E8 -8.1 5.17 -10.73 -2.26 0
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387230 134984507 1 ClNO2C13H16 ABC2D13E16 -73.13 4.41 -8.72 0.0 0
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387231 134984509 1 NO2C19H29 AB2C19D29 -92.49 1.8 -9.05 0.38 0
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387232 134984511 1 SN2O2C12H16 AB2C2D12E16 -4.82 3.81 -9.66 -0.11 0
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387233 134984512 1 NSO2C15H21 ABC2D15E21 -17.86 2.43 -8.22 0.4 0
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387234 134984517 1 NSCl3O4C13H16 ABC3D4E13F16 -162.73 3.21 -9.84 -1.07 0
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387235 134984519 1 N2O5C14H20 A2B5C14D20 -163.19 1.92 -10.44 -1.98 0
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387236 134984520 1 ClNO2C10H18 ABC2D10E18 -63.64 4.52 -10.72 -0.55 0
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387237 134984529 1 ClHNOC3F5 ABCDE3F5 -265.57 2.82 -11.63 -1.46 0
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387238 134984533 1 NO7C11H17 AB7C11D17 -253.81 5.06 -9.74 0.05 0
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387239 134984534 1 NSiO6C15H29 ABC6D15E29 -282.9 4.62 -9.22 -0.01 0
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387240 134984544 1 NCl2O2H9C13 AB2C2D9E13 22.23 3.24 -9.92 -1.0 0
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387241 134984545 1 BrC4N4O6H7 AB4C4D6E7 4.38 3.86 -9.97 -2.0 0
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387242 134984546 1 N4O8C13H24 A4B8C13D24 -86.74 1.76 -10.74 -1.7 0
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387243 134984548 1 F2H2N2C3O5 A2B2C2D3E5 -131.29 2.81 -11.79 -2.11 0
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387244 134984553 1 NO6C12H13 AB6C12D13 -153.23 2.66 -9.89 -0.96 0
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387245 134984559 1 NOC19H25 ABC19D25 12.52 0.83 -9.26 0.17 0
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387246 134984562 1 NO7C25H29 AB7C25D29 -232.33 3.49 -9.21 -0.81 0
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387247 134984564 1 ON2C19H24 AB2C19D24 17.07 1.41 -8.56 -0.16 0
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387248 134984565 1 OSN2C18H24 ABC2D18E24 12.46 2.23 -8.51 -0.48 0
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387249 134984566 2 NSO3C10H15 ABC3D10E15 -219.47 11.68 -9.66 -0.44 0
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387250 134984567 1 NOC20H25 ABC20D25 27.16 1.07 -9.22 0.29 0
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387252 134984572 2 NF2H7C9 AB2C7D9 63.98 4.51 -9.62 -0.2 0
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387253 134984573 2 NF2H7C9 AB2C7D9 58.81 0.78 -9.33 -0.02 0
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387254 134984576 1 OPC11H23 ABC11D23 -76.66 2.23 -8.12 1.25 0
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387255 134984591 1 ON2C12H26 AB2C12D26 -29.21 5.21 -9.72 0.35 1
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387256 134984594 1 Cl2N2C3H3 A2B2C3D3 50.29 2.81 0.0 0.0 0
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387257 134984616 1 NPO3F9C10H15 ABC3D9E10F15 -675.82 7.8 -10.1 0.05 0
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387258 134984618 1 NO2H11C12 AB2C11D12 1.63 1.0 -10.0 -1.06 0
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387259 134984629 1 NO2C21H25 AB2C21D25 -30.09 2.5 -9.32 0.14 0
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387260 134984630 1 NO2C22H27 AB2C22D27 -33.28 3.11 -9.19 0.2 0
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387261 134984631 1 ClNSiC23H30 ABCD23E30 32.19 3.31 -8.59 0.03 0
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387262 134984642 1 ClNO2H22C24 ABC2D22E24 6.41 3.66 -9.35 -0.26 0
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387263 134984643 1 ClNSO6H28C29 ABCD6E28F29 -156.45 7.91 -9.13 -0.86 0
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387264 134984647 1 NSiO2C11H19 ABC2D11E19 -42.93 4.63 -9.8 -0.2 0
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387265 134984657 2 NO4C7H9 AB4C7D9 -211.35 3.79 -9.37 -1.51 0
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387266 134984658 1 N4O8C13H24 A4B8C13D24 -87.1 3.5 -10.48 -1.62 0
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387267 134984663 1 NO4C11H13 AB4C11D13 -76.82 3.87 -9.77 -0.76 0
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387268 134984667 1 O4C23H32 A4B23C32 -182.37 2.66 -9.3 0.02 0
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387269 134984677 1 ClNSO3C16H16 ABCD3E16F16 -49.02 3.69 -9.3 -0.72 0
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387270 134984678 1 ClNSO3C16H16 ABCD3E16F16 -50.63 3.64 -9.35 -0.72 0
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387271 134984681 1 N3O3C22H25 A3B3C22D25 0.48 3.6 -8.32 -0.14 0
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387272 134984682 1 N3O3C22H25 A3B3C22D25 3.01 3.54 -8.32 0.0 0
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387273 134984684 1 N2O2F3C19H25 A2B2C3D19E25 -191.72 3.78 -9.22 -0.53 0
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387274 134984685 1 N2S2O6C21H34 A2B2C6D21E34 -254.21 9.74 -8.37 -0.46 -2
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387275 134984688 1 PTaSi3N4C19H48 ABC3D4E19F48 -191.88 35.27 -6.63 -1.19 0
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387277 134984703 4 NC4H5 AB4C5 104.78 0.28 -8.24 0.18 0
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387278 134984713 2 NC9H9 AB9C9 81.21 0.96 -8.28 -1.05 0
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387279 134984714 2 NC9H9 AB9C9 80.3 0.29 -8.42 -1.14 0
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387280 134984716 2 NC4H8 AB4C8 27.05 0.55 -8.72 0.59 0
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387282 134984723 1 N2O3H18C30 A2B3C18D30 77.82 2.49 -8.63 -2.26 0