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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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51530 12014213 1 OC13H14 AB13C14 17.47 1.78 -9.28 0.3 0
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51531 12014214 1 H12C13 A12B13 80.69 0.62 -9.08 0.41 0
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51532 12014215 2 NSO4C16H18 ABC4D16E18 -298.84 5.44 -8.66 -0.85 0
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51533 12014216 2 SO2N3C14H14 AB2C3D14E14 -43.19 2.59 -8.75 -1.22 0
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51534 12014217 1 O5C49H68 A5B49C68 -219.58 5.91 -9.38 0.0 0
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51535 12014218 1 N6O9C69H80 A6B9C69D80 -262.8 10.21 -9.24 -0.79 0
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51536 12014219 2 O2C13H13 A2B13C13 -100.11 1.55 -8.35 -0.46 0
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51537 12014221 1 N6O8C45H54 A6B8C45D54 -298.05 3.34 -9.4 -0.89 0
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51538 12014222 1 O3C49H64 A3B49C64 -78.25 2.32 -9.26 0.12 0
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51539 12014223 1 ClNOH8C11 ABCD8E11 33.63 1.9 -9.1 -0.96 0
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51540 12014224 2 O3C16H17 A3B16C17 -205.74 1.66 -8.15 -0.31 0
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51541 12014225 2 O3H25C27 A3B25C27 -132.74 3.09 -8.46 -0.67 0
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51542 12014226 3 OC8H14 AB8C14 -213.41 4.56 -9.98 2.73 0
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51543 12014227 1 O27C113H216 A27B113C216 -1452.43 9.59 -8.15 -0.11 1
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51544 12014232 1 N3H20C25 A3B20C25 145.84 3.62 0.0 0.0 0
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51545 12014233 1 IN3C16H18 AB3C16D18 75.63 4.16 -8.34 -1.0 1
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51546 12014234 1 N3C16H18 A3B16C18 70.7 4.09 0.0 0.0 0
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51547 12014235 1 O2Si2C23H48 A2B2C23D48 -223.33 0.86 -8.41 1.12 0
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51548 12014237 1 OSiC11H24 ABC11D24 -120.58 1.98 -9.35 0.92 0
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51549 12014238 1 SiO2C13H28 AB2C13D28 -190.96 2.98 -9.15 1.07 0
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51550 12014239 1 SiO4C12H24 AB4C12D24 -267.38 4.39 -9.32 1.0 0
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51551 12014240 1 SiO4C11H22 AB4C11D22 -262.95 4.13 -9.41 0.93 0
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51552 12014242 1 NC10H17 AB10C17 7.5 4.11 -10.1 0.75 0
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51553 12014243 1 NC11H19 AB11C19 0.86 4.0 -10.17 0.74 0
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51554 12014245 1 O3C19H30 A3B19C30 -127.01 1.84 -9.21 0.36 0
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51555 12014246 1 O3C16H32 A3B16C32 -170.67 4.29 -8.98 1.18 0
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51556 12014247 1 BrNO2C8H12 ABC2D8E12 -46.67 1.41 -10.16 -0.52 0
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51557 12014248 1 ClNO3H10C12 ABC3D10E12 -107.71 8.93 -9.24 -1.1 0
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51558 12014250 1 N3O6H13C18 A3B6C13D18 -148.91 9.38 -9.54 -1.99 0
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51559 12014251 1 O2N3F6H7C16 A2B3C6D7E16 -302.88 11.82 -9.74 -2.23 0
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51560 12014252 1 O5C35H42 A5B35C42 -122.26 1.52 -9.3 0.12 0
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51561 12014253 1 O3C25H34 A3B25C34 -87.32 2.0 -9.26 0.4 0
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51562 12014254 1 O3C23H30 A3B23C30 -52.44 1.57 -9.29 0.4 0
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51563 12014255 1 O3C27H38 A3B27C38 -74.61 2.77 -9.43 0.26 0
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51564 12014256 1 O2C15H20 A2B15C20 -59.67 2.18 -9.41 0.31 0
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51565 12014257 1 O2C13H16 A2B13C16 -32.61 2.6 -9.62 0.05 0
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51566 12014258 1 O2C17H24 A2B17C24 -56.13 1.68 -9.59 0.16 0
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51567 12014259 1 N2O5C10H18 A2B5C10D18 -209.83 4.25 -9.7 0.59 -1
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51571 12014263 1 BGeN9C15H23 ABC9D15E23 168.1 3.99 0.0 0.0 -4
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51572 12014264 1 BGeC15N15H22 ABC15D15E22 364.66 9.53 -7.2 -2.23 0
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51580 12014273 1 ClRhP2O8C48H48 ABC2D8E48F48 55.07 24.23 -8.68 -3.08 0
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51581 12014274 2 OSC4H7 ABC4D7 -86.39 2.14 -8.67 0.0 0
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51582 12014275 1 BrClOSN2H10C12 ABCDE2F10G12 1.96 7.71 -9.48 -0.96 0
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51583 12014276 1 BrClOSN2H10C12 ABCDE2F10G12 1.48 7.2 -9.54 -1.04 0
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51584 12014277 1 BrClOSN2H10C12 ABCDE2F10G12 1.43 6.7 -9.55 -1.04 0
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51585 12014279 1 OSBr2N2H10C12 ABC2D2E10F12 13.51 7.21 -9.54 -1.04 0
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51586 12014280 1 OSBr2N2H10C12 ABC2D2E10F12 13.43 6.71 -9.56 -1.07 0
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51587 12014283 1 BrSN3O3H10C12 ABC3D3E10F12 6.74 6.99 -9.73 -1.76 0
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51588 12014284 1 SO2N4H8C11 AB2C4D8E11 48.39 5.9 -9.44 -1.48 0
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51589 12014285 1 OS2N4H8C11 AB2C4D8E11 113.78 5.26 -9.24 -2.02 0
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51590 12014287 1 OS3N6H12C17 AB3C6D12E17 181.06 9.06 -9.37 -2.21 0
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51591 12014288 1 OSN7H13C18 ABC7D13E18 164.82 6.3 -9.24 -1.7 0
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51592 12014289 1 OSN6H18C21 ABC6D18E21 149.47 3.72 -8.52 -1.46 0
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51593 12014290 1 S2N5H11C17 A2B5C11D17 215.79 6.23 -8.99 -1.62 0
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51594 12014291 1 SO2N6H14C21 AB2C6D14E21 136.15 4.18 -9.8 -1.8 0
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51595 12014292 1 SO4N7H13C21 AB4C7D13E21 132.85 4.96 -10.18 -2.05 0
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51596 12014294 1 OS2N5H13C18 AB2C5D13E18 121.37 10.7 -8.71 -1.11 0
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51597 12014295 1 OSN6H14C18 ABC6D14E18 120.26 10.53 -8.67 -1.0 -2
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51598 12014296 2 NOZnSi3C15H40 ABCD3E15F40 -476.92 4.4 -8.7 -0.98 -2
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51599 12014297 2 NOZnSi3C12H34 ABCD3E12F34 -429.95 4.18 -7.49 -0.36 0
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51600 12014298 4 OSiZnC4H12 ABCD4E12 -298.2 5.58 -9.12 -1.7 -4
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51602 12014300 2 INH7C11 ABC7D11 147.52 0.35 -9.11 -1.34 0
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51603 12014301 2 NSiC18H18 ABC18D18 217.27 3.38 -8.2 -1.05 0
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51604 12014302 2 NSiC14H16 ABC14D16 34.28 0.05 -8.51 -1.0 0
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51605 12014303 2 OCl3H6C7 AB3C6D7 -80.21 3.2 -9.78 -0.66 0
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51606 12014306 2 Cl3H4C6 A3B4C6 -0.6 3.93 -9.91 -0.58 0
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51607 12014307 2 N2O4C23H28 A2B4C23D28 -221.06 6.0 -7.68 -0.55 0
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51608 12014308 3 N2O4C23H28 A2B4C23D28 -64.69 5.27 -7.82 -0.67 0
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51612 12014312 1 O4H16C17 A4B16C17 -128.02 8.16 -8.95 -1.26 0
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51613 12014313 1 SO2C20H26 AB2C20D26 -60.89 5.37 -8.16 -0.13 0
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51614 12014314 1 SO2C17H26 AB2C17D26 -95.39 4.22 -8.27 -0.04 0
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51615 12014315 1 SO2C14H22 AB2C14D22 -90.01 3.79 -8.3 -0.03 0
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51616 12014316 1 SO2C13H20 AB2C13D20 -83.18 3.09 -8.32 -0.12 0
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51617 12014317 1 SO3C19H24 AB3C19D24 -101.64 4.16 -9.54 -0.57 0
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51618 12014318 1 SO3C16H24 AB3C16D24 -135.39 5.45 -10.21 -0.55 0