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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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405518 135074304 1 FN2O2H8C9 AB2C2D8E9 -36.84 4.2 0.0 0.0 0
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405519 135074305 1 ClNOC19H22 ABCD19E22 -19.43 2.49 -7.93 -0.08 0
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405520 135074306 1 SN3O3F8H13C23 AB3C3D8E13F23 -369.22 5.35 -9.37 -1.62 0
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405521 135074307 1 NOC19H25 ABC19D25 -21.07 2.46 -7.75 0.34 0
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405522 135074308 1 Cl2N2C9H10 A2B2C9D10 33.28 5.02 -8.73 -0.61 0
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405523 135074310 1 NO2H19C21 AB2C19D21 -16.02 4.95 -8.59 -0.34 0
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405524 135074311 1 N3C14H15 A3B14C15 80.59 1.65 -8.46 -0.6 0
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405525 135074313 1 N3C15H17 A3B15C17 74.85 1.7 -8.34 -0.28 0
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405526 135074314 1 FNH14C18 ABC14D18 21.9 2.9 -8.51 -0.21 0
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405527 135074315 1 ClNSO2H16C19 ABCD2E16F19 -19.91 7.14 -9.04 -0.58 0
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405528 135074316 1 NSO3H19C21 ABC3D19E21 -54.67 9.12 -9.0 -0.69 0
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405529 135074317 1 NO3C18H21 AB3C18D21 -27.95 4.27 -8.51 -0.56 0
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405530 135074318 1 PO10C59H61 AB10C59D61 -282.98 9.93 -9.06 -0.18 3
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405531 135074319 1 BO3C12H30 AB3C12D30 -151.1 0.41 0.0 0.0 0
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405532 135074320 1 NO3H21C26 AB3C21D26 -28.52 4.34 -9.19 -0.75 0
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405533 135074321 1 FNC20H20 ABC20D20 -0.91 2.92 -8.4 -0.06 0
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405534 135074323 1 SN2O6C12H24 AB2C6D12E24 -303.11 6.08 -10.49 -0.55 0
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405535 135074324 1 ON2F3C17H17 AB2C3D17E17 -169.91 4.03 -9.89 -0.52 0
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405536 135074325 1 NO3C12H15 AB3C12D15 -69.62 2.33 -9.42 -0.1 0
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405537 135074326 2 NOH7C8 ABC7D8 11.49 3.0 -8.74 -1.02 0
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405538 135074327 1 IO2C17H19 AB2C17D19 -3.71 2.77 -9.6 -0.87 0
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405539 135074328 1 IC13H21 AB13C21 22.12 2.7 -9.53 -0.72 0
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405540 135074330 1 Cl2O5C30H32 A2B5C30D32 -141.9 2.32 -8.88 -0.51 0
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405542 135074340 1 O2C23H26 A2B23C26 -46.78 5.41 -8.64 -0.3 0
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405543 135074368 1 OH14C16 AB14C16 55.45 0.44 -8.7 -0.54 0
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405544 135074374 1 NC18H19 AB18C19 79.42 1.8 -9.22 -0.26 0
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405545 135074418 1 SF3O4H15C20 AB3C4D15E20 -243.69 6.67 -8.97 -1.06 0
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405546 135074444 1 PN3O3C15H16 AB3C3D15E16 -90.68 3.44 -9.22 -0.56 0
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405547 135074445 1 NO3C11H13 AB3C11D13 -59.91 1.65 -9.55 -0.31 0
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405548 135074446 1 NSO2C17H19 ABC2D17E19 -36.81 7.01 -9.05 -0.6 0
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405549 135074448 1 SN2O2C15H16 AB2C2D15E16 -27.76 7.37 -8.89 -1.12 0
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405550 135074449 1 OSiN2C18H24 ABC2D18E24 -18.35 4.02 -9.26 -0.55 0
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405551 135074451 1 NSH13C15 ABC13D15 53.41 1.06 -8.84 -0.7 0
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405552 135074452 1 NSSiO3C20H27 ABCD3E20F27 -134.62 7.0 -8.79 -0.82 0
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405553 135074453 1 ISiN2C16H21 ABC2D16E21 43.5 1.04 -9.1 -0.61 0
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405554 135074454 1 NSO2C16H17 ABC2D16E17 -37.55 5.88 -8.84 -0.76 0
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405555 135074455 1 NSO2C16H17 ABC2D16E17 -39.12 5.73 -9.05 -0.59 0
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405556 135074457 1 BrSN2O2H13C14 ABC2D2E13F14 -23.2 5.64 -8.12 -0.98 0
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405558 135074460 1 NSO5C11H21 ABC5D11E21 -253.99 3.29 -10.6 -0.87 0
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405559 135074461 1 NO4C16H19 AB4C16D19 -128.8 1.42 -9.85 -0.24 0
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405560 135074462 1 NSSiO4C28H39 ABCD4E28F39 -186.04 6.17 -8.91 -0.51 0
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405561 135074463 1 OSSiC16H24 ABCD16E24 -66.56 1.79 -8.36 0.06 0
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405562 135074464 1 O3C17H20 A3B17C20 -31.12 1.38 -8.81 -0.12 0
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405563 135074466 1 O3C18H22 A3B18C22 -42.22 1.44 -8.74 -0.05 0
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405564 135074467 1 BrNOH18C22 ABCD18E22 127.03 3.17 -9.46 -0.61 0
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405565 135074468 1 BrNOF2H16C22 ABCD2E16F22 35.56 2.86 -9.67 -0.67 0
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405566 135074469 1 IO5C28H31 AB5C28D31 -113.95 2.75 -9.32 -1.11 0
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405567 135074470 1 SO5C14H24 AB5C14D24 -201.61 3.77 -9.76 0.14 0
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405568 135074471 1 SiO3C17H32 AB3C17D32 -209.35 1.57 -9.3 1.09 0
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405569 135074472 1 O6C19H32 A6B19C32 -234.61 3.37 -10.15 0.07 0
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405570 135074474 1 NSSiO2C23H29 ABCD2E23F29 48.39 5.59 -9.35 -0.42 0
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405571 135074475 1 NSO3C24H29 ABC3D24E29 7.84 6.65 -9.13 -0.47 0
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405572 135074476 1 O8C35H54 A8B35C54 -339.3 4.49 -9.52 -0.44 0
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405573 135074477 1 O3C30H40 A3B30C40 -106.35 2.18 -9.06 -0.86 0
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405574 135074478 1 O3C18H22 A3B18C22 -29.45 1.6 -8.82 0.3 0
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405575 135074480 1 O3C19H24 A3B19C24 -96.85 3.96 -9.98 -0.49 0
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405576 135074482 1 O5C32H38 A5B32C38 -129.75 4.11 -8.59 -0.02 0
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405577 135074483 1 BClSO5C18H28 ABCD5E18F28 -307.11 3.56 -10.34 -1.06 0
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405578 135074485 1 NSO3C13H17 ABC3D13E17 -55.03 8.21 -9.28 -0.82 0
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405579 135074510 1 NO7H13C14 AB7C13D14 -156.94 4.52 -10.67 -1.99 0
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405580 135074522 1 ISiO2C25H43 ABC2D25E43 -143.26 3.37 -8.85 -0.54 0
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405581 135074524 1 N2O3H18C24 A2B3C18D24 130.41 5.26 -9.48 -1.52 0
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405582 135074535 1 BISi6O14C82H160 ABC6D14E82F160 -1099.14 4.15 -8.98 -0.57 0
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405583 135074547 1 SiBr2O2C28H44 AB2C2D28E44 -130.12 3.19 -8.78 -0.57 0
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405584 135074551 1 SN2O4C15H22 AB2C4D15E22 -71.01 4.22 -9.88 -1.95 0
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405585 135074560 1 SN2O4C19H22 AB2C4D19E22 -43.14 5.17 -9.32 -1.73 0
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405586 135074567 1 SiC10H16 AB10C16 -16.49 1.22 -8.7 0.6 0
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405587 135074568 1 N2O2H16C19 A2B2C16D19 64.98 6.42 -8.64 -1.32 0
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405588 135074596 1 SiO5C28H42 AB5C28D42 -145.52 2.52 -9.23 0.35 0
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405589 135074599 1 BrNO4C17H20 ABC4D17E20 -125.16 2.1 -9.6 -0.02 0
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405590 135074600 1 NPO6C11H16 ABC6D11E16 -230.13 5.8 -10.02 -0.74 0
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405591 135074601 1 BrPO4C11H16 ABC4D11E16 -227.79 1.67 -9.73 -0.57 0
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405592 135074602 4 OC7H8 AB7C8 -74.71 3.07 -9.38 -0.79 0
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405593 135074603 1 NS2O5C34H35 AB2C5D34E35 -81.97 8.81 -8.6 -0.56 0
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405594 135074604 1 FNS2O5C28H30 ABC2D5E28F30 -156.88 8.63 -8.96 -0.55 0
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405595 135074605 1 INS2O5C28H30 ABC2D5E28F30 -110.25 5.96 -8.91 -0.89 0
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405596 135074606 1 NS2O5C29H33 AB2C5D29E33 -117.57 7.43 -9.22 -0.53 0
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405597 135074607 2 O2C11H11 A2B11C11 -77.54 4.17 -9.47 -1.02 0
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405598 135074610 1 FO3H13C14 AB3C13D14 -95.74 4.79 -9.75 -0.73 0
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405599 135074611 1 O4C17H20 A4B17C20 -106.12 5.21 -9.0 -0.48 0
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405600 135074613 1 SO4C27H28 AB4C27D28 -76.87 5.73 -8.61 -0.63 0
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405601 135074615 1 BrO5C20H27 AB5C20D27 -173.61 4.91 -9.8 -0.15 0
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405602 135074618 1 N2O3C16H16 A2B3C16D16 2.5 6.66 -8.98 -0.62 0
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405603 135074620 1 OC17H20 AB17C20 -5.05 3.11 -9.47 0.17 0
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405604 135074621 1 BrN2F3H8C12 AB2C3D8E12 -82.2 5.5 -8.98 -1.17 0
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405605 135074622 1 Si2O3C26H40 A2B3C26D40 -80.67 0.47 -8.76 -0.49 0
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405606 135074623 1 SF3O5C14H15 AB3C5D14E15 -336.6 3.16 -10.22 -1.62 0
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405607 135074624 1 ClNF3H13C17 ABC3D13E17 -86.74 2.51 -9.53 -0.73 0
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405608 135074625 1 OC14H26 AB14C26 -69.33 2.34 -9.3 1.14 0
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405609 135074628 1 NO5H9C12 AB5C9D12 -22.44 9.65 -10.19 -1.48 0
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405610 135074630 1 OSiC27H28 ABC27D28 44.44 0.84 -8.58 -0.73 0
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405611 135074631 1 OH22C32 AB22C32 205.28 2.32 -8.5 -0.74 0
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405612 135074632 1 ClN2O3C22H23 AB2C3D22E23 -58.77 4.54 -8.57 -0.22 0
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405613 135074633 1 FN2O3C23H25 AB2C3D23E25 -99.09 2.75 -8.65 -0.36 0
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405614 135074634 1 N2O3C29H30 A2B3C29D30 -26.04 3.16 -8.31 -0.32 0
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405615 135074637 1 Br2C17H18 A2B17C18 25.31 2.06 -9.23 -0.31 0
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405616 135074639 1 NBr2O2C14H19 AB2C2D14E19 -88.14 2.63 -9.8 -0.6 0
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405617 135074649 1 BrO2H13C16 AB2C13D16 21.65 0.6 -8.6 -0.61 0
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405618 135074658 1 O2C15H24 A2B15C24 -112.15 1.68 -8.89 0.21 0
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405619 135074668 1 NOC13H17 ABC13D17 -7.33 3.08 -8.35 0.01 0