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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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72452 48416190 1 NO5C18H25 AB5C18D25 -213.69 2.62 -8.68 0.29 0
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72453 48416191 1 NO5C22H27 AB5C22D27 -183.51 4.81 -8.79 -0.06 0
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72454 48416192 1 N2O6C21H24 A2B6C21D24 -153.6 3.8 -8.98 -1.52 0
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72455 48416193 1 NO5C23H29 AB5C23D29 -189.73 5.56 -8.72 -0.11 0
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72456 48416195 1 N2O5C22H26 A2B5C22D26 -190.4 4.55 -8.65 -0.47 0
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72457 48416196 1 NO4C22H27 AB4C22D27 -148.94 4.78 -8.95 -0.05 0
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72458 48416197 1 NO4C20H29 AB4C20D29 -187.39 4.54 -8.73 0.21 0
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72459 48416199 1 N2O4C23H26 A2B4C23D26 -127.64 4.78 -8.71 -0.24 0
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72460 48416200 1 NO4C21H25 AB4C21D25 -146.15 4.71 -8.65 -0.21 0
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72461 48416201 1 NO5C21H25 AB5C21D25 -176.81 0.82 -8.6 0.12 0
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72462 48416202 1 N3O4C18H21 A3B4C18D21 -111.43 1.73 -8.7 -1.23 0
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72463 48416203 1 NO5C21H25 AB5C21D25 -175.77 5.11 -8.76 -0.4 0
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72464 48416204 1 NO6C21H23 AB6C21D23 -200.12 5.76 -8.95 -0.55 0
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72465 48416205 1 BrNO5C18H20 ABC5D18E20 -157.84 1.25 -8.74 -0.89 0
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72466 48416206 1 ClN2O4C19H21 AB2C4D19E21 -133.61 2.69 -8.89 -1.02 0
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72467 48416207 1 N2O4C21H22 A2B4C21D22 -104.52 6.03 -8.79 -1.01 0
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72468 48416208 1 NO4C18H25 AB4C18D25 -163.13 3.46 -8.84 -0.01 0
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72469 48416210 1 NO4C21H25 AB4C21D25 -146.9 1.58 -8.69 -0.07 0
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72470 48416211 2 NO2C11H14 AB2C11D14 -135.83 3.28 -8.43 -0.18 0
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72471 48416212 1 NO6C22H27 AB6C22D27 -211.28 7.67 -8.63 -0.45 0
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72472 48416213 1 NO6C22H27 AB6C22D27 -220.57 7.14 -8.38 -0.29 0
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72473 48416214 1 NO6C22H27 AB6C22D27 -221.03 3.8 -8.76 -0.28 0
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72474 48416215 1 ClNO4C20H22 ABC4D20E22 -146.17 2.67 -8.68 -0.56 0
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72475 48416216 1 N2O4C19H22 A2B4C19D22 -126.77 2.27 -8.67 -0.77 0
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72476 48416217 1 NO4C17H25 AB4C17D25 -181.17 5.65 -8.57 0.37 0
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72477 48416218 1 N2O4C19H22 A2B4C19D22 -125.77 4.27 -9.11 -0.56 0
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72478 48416219 1 N2O7C21H24 A2B7C21D24 -180.56 3.67 -8.72 -1.45 0
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72479 48416220 2 NO2C12H14 AB2C12D14 -133.14 2.75 -8.43 0.02 0
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72480 48416221 1 SN2O4C21H22 AB2C4D21E22 -107.87 3.9 -8.75 -1.2 0
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72481 48416223 1 FNO4C20H22 ABC4D20E22 -188.12 5.02 -8.65 -0.49 0
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72482 48416224 1 NO5C20H23 AB5C20D23 -180.96 4.63 -8.61 -0.46 0
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72483 48416225 1 N2O4C19H22 A2B4C19D22 -127.18 4.41 -8.8 -0.71 0
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72484 48416226 1 NSO5C21H25 ABC5D21E25 -175.78 2.85 -8.75 -1.04 0
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72485 48416227 1 NO5C21H25 AB5C21D25 -175.09 2.58 -8.58 -0.31 0
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72486 48416228 1 NO5C18H21 AB5C18D21 -164.32 4.12 -8.6 -0.42 0
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72487 48416229 2 NO3C10H11 AB3C10D11 -140.87 8.82 -9.04 -1.54 0
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72488 48416230 1 NSO4C19H23 ABC4D19E23 -142.72 1.96 -8.58 -0.68 0
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72489 48416231 1 NSO4C19H23 ABC4D19E23 -142.83 5.21 -8.64 -0.62 0
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72490 48416232 1 NO5C21H25 AB5C21D25 -176.19 3.99 -8.5 -0.27 0
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72491 48416233 1 NO6C23H29 AB6C23D29 -219.39 4.41 -8.48 -0.1 0
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72492 48416234 1 NO4C17H23 AB4C17D23 -147.85 3.06 -8.59 0.34 0
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72493 48416235 1 FNO4C20H22 ABC4D20E22 -184.34 3.04 -8.54 -0.63 0
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72494 48416236 1 NO4C20H23 AB4C20D23 -136.16 2.02 -8.65 -0.34 0
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72495 48416237 1 SN2O5C18H24 AB2C5D18E24 -200.75 2.64 -8.68 -0.56 0
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72496 48416238 1 N2O5C23H26 A2B5C23D26 -153.17 3.18 -8.75 -0.77 0
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72497 48416239 1 NO4C20H27 AB4C20D27 -164.79 4.64 -8.7 0.22 0
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72498 48416240 1 NSO6C21H25 ABC6D21E25 -217.8 3.59 -8.63 -1.06 0
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72499 48416241 1 N3O5C22H29 A3B5C22D29 -176.04 1.83 -8.7 -1.03 0
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72500 48416242 1 N2O6C21H26 A2B6C21D26 -218.39 1.78 -8.66 -0.41 0
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72501 48416243 1 NO5C22H23 AB5C22D23 -148.08 5.31 -8.86 -0.82 0