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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217752 85088324 1 ClO2N4H19C21 AB2C4D19E21 -18.95 6.49 -9.22 -0.57 0
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217753 85088327 1 O4N7H17C18 A4B7C17D18 108.13 13.2 -8.74 -1.57 0
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217754 85088328 1 NO5C23H25 AB5C23D25 -115.26 4.01 -9.11 -0.04 0
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217755 85088331 1 FOSN3C22H22 ABCD3E22F22 4.94 3.97 -8.76 -0.82 0
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217756 85088332 1 NO4C23H41 AB4C23D41 -213.41 1.41 -10.46 -0.43 0
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217757 85088333 1 ClNO5C20H26 ABC5D20E26 -125.48 3.35 -8.31 -0.78 0
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217758 85088334 1 ClNS2O6C14H18 ABC2D6E14F18 -232.55 4.49 -9.56 -1.18 0
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217759 85088337 1 N4O5C20H20 A4B5C20D20 -88.27 5.79 -9.51 -1.9 0
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217760 85088342 1 N2O4C23H28 A2B4C23D28 -113.92 3.03 -9.04 -1.12 0
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217761 85088344 1 O4C25H32 A4B25C32 -136.66 5.05 -9.28 -1.11 0
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217762 85088345 2 SO2C10H14 AB2C10D14 -137.26 2.14 -8.48 -0.5 0
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217763 85088347 4 OC6H11 AB6C11 -248.7 2.15 -10.14 -0.48 0
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217764 85088348 1 SiO2C25H36 AB2C25D36 -118.44 1.86 -8.85 0.24 0
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217765 85088351 1 ClO6C20H25 AB6C20D25 -276.75 4.27 -9.67 -0.8 0
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217766 85088352 1 BrN2O3C19H19 AB2C3D19E19 -63.79 3.44 -9.05 -0.45 0
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217767 85088356 1 N5O6C17H29 A5B6C17D29 -223.15 7.61 -10.0 -0.16 0
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217768 85088357 1 NO5C23H27 AB5C23D27 -208.01 6.56 -9.36 -0.14 0
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217769 85088358 1 N3O6C19H31 A3B6C19D31 -259.4 5.03 -8.89 -0.34 0
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217770 85088359 1 O3N5C21H27 A3B5C21D27 -36.03 9.08 -9.03 -0.72 0
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217771 85088360 1 NS2O5C18H23 AB2C5D18E23 -160.64 2.42 -9.3 -0.89 0
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217772 85088361 1 FN3O3C21H38 AB3C3D21E38 -253.84 3.12 -10.36 -0.66 0
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217773 85088362 1 O2N3C24H35 A2B3C24D35 -90.76 3.48 -8.87 0.16 0
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217774 85088363 1 Cl3O8C12H19 A3B8C12D19 -402.58 2.95 -10.53 -0.26 0
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217775 85088364 1 NOC27H43 ABC27D43 60.57 1.58 -4.96 -1.34 0
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217776 85088366 1 SF3O7C15H17 AB3C7D15E17 -417.52 3.76 -9.82 -1.42 0
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217777 85088367 2 O5C9H11 A5B9C11 -418.01 1.01 -9.92 -0.42 1
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217778 85088375 1 N4O4C21H25 A4B4C21D25 -92.02 6.53 0.0 0.0 0
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217779 85088377 1 PSN2O5C16H35 ABC2D5E16F35 -317.5 11.72 -8.4 -0.26 1
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217780 85088378 1 PSN2O5C16H36 ABC2D5E16F36 -299.3 3.48 0.0 0.0 0
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217781 85088379 1 N2O3C23H46 A2B3C23D46 -235.52 3.51 -9.36 0.87 0
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217782 85088380 1 OSSiN2C22H30 ABCD2E22F30 1.16 4.45 -8.11 -0.09 0
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217783 85088381 1 OC28H46 AB28C46 -108.6 4.04 -9.8 0.19 0
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217784 85088382 1 BrN4O5C14H15 AB4C5D14E15 -128.04 1.21 -9.35 -1.9 0
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217785 85088383 1 N5O6H17C18 A5B6C17D18 -165.29 8.62 -9.47 -1.32 0
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217786 85088384 1 NO6C22H25 AB6C22D25 -227.46 5.95 -9.13 0.07 0
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217787 85088385 1 O4N5C20H25 A4B5C20D25 -92.82 8.76 -8.39 0.04 0
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217788 85088391 1 NSSiO4C19H33 ABCD4E19F33 -203.51 6.89 -8.92 -0.46 0
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217789 85088392 2 ClMgH8C11 ABC8D11 -68.79 3.2 -8.1 -1.59 0
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217790 85088393 1 P3C7O13H15 A3B7C13D15 -761.63 5.47 -10.76 -0.44 0
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217791 85088394 1 IN2O4C14H17 AB2C4D14E17 -70.3 6.76 -9.33 -1.84 0
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217792 85088398 1 SN2O5C20H20 AB2C5D20E20 -148.2 7.37 -9.6 -1.01 0
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217793 85088399 1 O6C23H28 A6B23C28 -229.12 2.46 -9.38 -0.14 0
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217794 85088401 1 ON6C23H24 AB6C23D24 94.69 5.76 -9.5 -1.15 0
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217795 85088402 1 S3N4O4C14H16 A3B4C4D14E16 -79.13 6.92 -9.09 -1.33 0
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217796 85088405 1 O5C24H32 A5B24C32 -189.9 4.83 -8.27 -0.83 0
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217797 85088407 2 NOC13H14 ABC13D14 -49.88 2.22 -8.53 -0.3 0
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217798 85088408 1 SiO5C22H28 AB5C22D28 -233.42 2.8 -9.18 -0.09 0
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217799 85088409 2 O3C11H20 A3B11C20 -340.32 1.57 -9.91 0.38 0
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217800 85088410 1 O4C25H36 A4B25C36 -156.36 3.1 -9.13 -1.7 0
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217801 85088412 1 ClN2O4C21H21 AB2C4D21E21 -122.74 4.43 -8.61 -0.9 0
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217802 85088413 1 SnO2C18H34 AB2C18D34 -103.87 4.49 -9.09 0.98 0
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217803 85088414 1 BrO4H17C20 AB4C17D20 -95.41 7.27 -9.37 -0.96 0
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217804 85088415 1 BrO5C18H25 AB5C18D25 -124.49 7.94 -8.38 -0.1 -1
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217805 85088416 1 FN4O4C20H22 AB4C4D20E22 16.27 6.21 0.0 0.0 0
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217806 85088417 1 NO6C22H27 AB6C22D27 -227.05 2.76 -9.69 -0.26 0
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217807 85088419 1 NSO5C21H23 ABC5D21E23 -142.18 4.77 -8.46 -0.82 0
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217808 85088420 1 NSSiO5C18H31 ABCD5E18F31 -247.97 3.12 -9.12 -0.18 0
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217809 85088421 1 NSO4C21H39 ABC4D21E39 -206.06 6.61 -9.9 0.15 0
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217810 85088422 1 NSiO5C20H39 ABC5D20E39 -255.28 2.93 -8.78 0.1 0
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217811 85088423 1 NO4C23H47 AB4C23D47 -281.73 4.76 -9.92 0.87 0
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217812 85088424 1 ClOSN5C19H20 ABCD5E19F20 29.38 5.37 -8.81 -0.92 0
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217813 85088425 1 ClO2N3C22H28 AB2C3D22E28 -55.2 5.1 -8.51 -0.07 0
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217814 85088426 1 Cl2N5O5H13C14 A2B5C5D13E14 -141.92 4.4 -9.2 -0.77 0
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217815 85088427 1 BrNSO3H12C18 ABCD3E12F18 -40.98 2.78 -9.56 -1.32 0
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217816 85088428 1 IS2N4H11C12 AB2C4D11E12 106.18 3.53 -8.73 -1.72 0
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217817 85088429 2 F4H5C10 A4B5C10 -290.17 2.82 -9.98 -1.47 0
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217818 85088430 1 O10C19H20 A10B19C20 -394.91 2.42 -8.99 -0.99 0
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217819 85088431 1 N4O9C15H24 A4B9C15D24 -373.05 4.3 -9.74 -0.27 0
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217820 85088432 1 O8C21H22 A8B21C22 -279.12 4.01 -8.96 -0.36 0
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217821 85088433 6 OH3C4 AB3C4 -150.23 4.9 -8.65 -2.27 0
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217822 85088435 1 N2O5H18C23 A2B5C18D23 -86.84 2.8 -8.51 -1.28 0
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217823 85088436 1 O7C22H26 A7B22C26 -230.73 3.19 -8.42 -0.18 0
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217824 85088438 1 O7C22H26 A7B22C26 -250.13 1.17 -9.58 -0.1 0
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217825 85088439 2 NO2H11C12 AB2C11D12 -84.12 3.63 -8.08 -0.64 0
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217826 85088440 1 SO6C21H22 AB6C21D22 -184.0 5.66 -8.68 -0.45 0