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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