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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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441504 135235429 1 SO2F4N6H16C19 AB2C4D6E16F19 -166.44 9.53 -9.64 -1.4 0
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441505 135235430 1 SO2F4N6H16C19 AB2C4D6E16F19 -165.33 7.6 -9.72 -1.48 0
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441506 135235532 1 N3O3C23H29 A3B3C23D29 -56.92 5.38 -9.06 -0.71 0
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441507 135235535 1 N2O6C25H26 A2B6C25D26 -159.18 6.89 -9.47 -0.37 0
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441508 135235538 1 PN11O13C61H68 AB11C13D61E68 -365.67 10.39 -8.58 -1.08 0
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441509 135235544 1 O8C29H36 A8B29C36 -290.85 4.06 -8.32 -0.52 0
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441510 135235545 5 NOC5H5 ABC5D5 -42.48 6.43 -9.5 -0.58 0
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441511 135235546 1 O6N7C43H43 A6B7C43D43 -53.69 0.92 -8.93 -0.51 0
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441512 135235547 1 O3N6C22H22 A3B6C22D22 -7.75 6.22 -8.77 -0.8 0
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441513 135235548 1 N3O5C26H29 A3B5C26D29 -137.51 8.46 -9.31 -0.15 0
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441514 135235649 1 O4C29H58 A4B29C58 -310.01 9.34 -10.77 0.61 0
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441515 135235650 1 O3C29H56 A3B29C56 -260.02 4.88 -10.61 0.16 0
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441516 135235651 1 FO3N4C20H21 AB3C4D20E21 -57.84 3.36 -8.53 -0.3 0
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441517 135235652 1 SN2O5F6H14C20 AB2C5D6E14F20 -398.27 7.91 -9.43 -1.39 0
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441518 135235653 1 OC16H18 AB16C18 -11.55 0.94 -8.51 0.23 0
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441519 135235655 1 N2O3H20C21 A2B3C20D21 -39.55 5.82 -8.73 -0.56 0
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441520 135235656 1 BrN2O2H13C17 AB2C2D13E17 24.88 3.39 -9.19 -0.62 0
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441521 135235660 1 ClOF3N3H11C16 ABC3D3E11F16 -100.85 6.59 -9.25 -1.04 0
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441522 135235661 1 ON4H16C20 AB4C16D20 99.25 4.78 -9.07 -0.7 0
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441523 135235664 1 OF2N3H15C21 AB2C3D15E21 -25.9 5.99 -9.22 -1.13 0
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441524 135235666 1 OF3N3H12C20 AB3C3D12E20 -69.75 5.11 -9.36 -1.17 0
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441525 135235770 1 OF2N3H15C21 AB2C3D15E21 -25.75 4.16 -9.41 -1.01 0
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441526 135235771 1 ON2F3H13C18 AB2C3D13E18 -112.25 4.91 -9.65 -0.93 0
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441527 135235775 1 N2O3H22C25 A2B3C22D25 -0.11 2.57 -8.83 -0.21 0
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441528 135235776 1 F2O2N3H13C19 A2B2C3D13E19 -59.31 4.87 -9.5 -0.94 0
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441529 135235777 1 N2O2F3H15C19 A2B2C3D15E19 -141.91 6.0 -9.63 -1.16 0
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441530 135235778 1 O2F3N3H12C18 A2B3C3D12E18 -126.49 6.75 -9.02 -1.24 0
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441531 135235779 1 N2O3H20C21 A2B3C20D21 -45.43 5.59 -9.44 -0.72 0
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441532 135235780 2 ON2H8C10 AB2C8D10 70.3 4.59 -9.46 -1.1 0
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441533 135235893 1 N2O2H18C19 A2B2C18D19 6.09 4.22 -8.89 -0.34 0
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441534 135235895 2 NOH9C10 ABC9D10 35.06 4.53 -8.7 -0.5 0
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441535 135235897 1 N2O2F4H14C19 A2B2C4D14E19 -194.54 6.19 -9.37 -0.91 0
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441536 135235898 1 N2O2F3H15C19 A2B2C3D15E19 -146.16 9.0 -8.87 -0.9 0
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441537 135235900 1 ClOF2N4H13C19 ABC2D4E13F19 -14.99 5.33 -8.82 -0.97 0
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441538 135235905 1 O2N3F4H11C17 A2B3C4D11E17 -160.97 2.2 -9.3 -1.43 0
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441539 135235906 1 NOSF3H14C19 ABCD3E14F19 -116.05 7.01 -8.7 -0.81 0
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441540 135235907 1 ON3H17C20 AB3C17D20 79.32 2.34 -8.6 -0.86 0
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441541 135235957 2 NOF2H6C9 ABC2D6E9 -184.29 9.94 -9.14 -0.94 0
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441542 135236011 2 O2C5H8 A2B5C8 -180.6 2.8 -9.11 0.38 -1
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441543 135236012 1 NSO4C7H14 ABC4D7E14 -159.77 1.5 0.0 0.0 3
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441545 135236014 2 OC6H8 AB6C8 -92.68 6.03 -9.96 -0.27 0
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441546 135236016 2 O2C16H23 A2B16C23 -204.53 8.06 -9.03 -0.28 0
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441547 135236017 1 O5C30H36 A5B30C36 -163.09 5.64 -9.1 -1.78 0
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441548 135236018 2 O2C16H23 A2B16C23 -206.16 6.7 -9.15 -0.28 0
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441549 135236019 1 O3C11H18 A3B11C18 -159.51 3.53 -9.84 0.2 1
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441550 135236020 1 HPC2O3F5 ABC2D3E5 -408.39 2.9 0.0 0.0 0
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441551 135236021 2 O2C7H10 A2B7C10 -160.8 4.14 -10.34 -0.58 0
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441552 135236023 1 O5C32H44 A5B32C44 -203.7 4.59 -9.48 -2.0 0
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441553 135236126 1 SF2O3N5H19C25 AB2C3D5E19F25 -91.32 9.64 -8.77 -0.82 0
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441554 135236128 1 SF2O3N4H16C21 AB2C3D4E16F21 -119.2 3.34 -8.72 -0.89 0