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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191579 78164844 1 SF3O3N4C24H33 AB3C3D4E24F33 -262.47 7.71 -8.46 -0.71 0
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191580 78164845 1 SO3F4N4C23H32 AB3C4D4E23F32 -309.72 4.66 -8.57 -0.72 0
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191581 78164846 1 ClSO3N4C22H33 ABC3D4E22F33 -114.27 5.7 -8.48 -0.4 0
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191582 78164847 1 SO3N4C21H32 AB3C4D21E32 -106.41 5.07 -8.51 0.0 0
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191583 78164848 1 SF3O3N4C24H35 AB3C3D4E24F35 -271.7 6.42 -8.49 -0.83 0
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191584 78164849 1 SF3N4O4C23H33 AB3C4D4E23F33 -306.65 4.08 -8.52 -0.86 0
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191585 78164850 1 ClON2H21C24 ABC2D21E24 38.27 3.6 -9.39 -0.66 0
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191586 78164857 1 OC21H32 AB21C32 -23.28 3.11 -8.43 0.23 0
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191587 78165415 1 SiO3C18H34 AB3C18D34 -205.41 2.48 -8.71 0.47 0
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191588 78165490 1 SCl2N3C13H13 AB2C3D13E13 60.3 5.05 -8.69 -0.77 0
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191589 78165491 1 SCl2N3C14H15 AB2C3D14E15 55.78 5.38 -8.67 -0.82 0
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191590 78165492 1 SCl2N3C15H17 AB2C3D15E17 50.34 4.86 -8.72 -0.54 0
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191592 78165494 1 N3O3C19H21 A3B3C19D21 -84.25 6.57 -9.0 -0.28 0
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191593 78165495 1 N4O6H32C37 A4B6C32D37 38.41 5.63 -9.14 -1.57 0
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191594 78165496 1 N2O2Cl4H30C37 A2B2C4D30E37 19.6 1.39 -8.74 -1.05 0
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191595 78165931 1 Cl2N2O2C29H36 A2B2C2D29E36 -67.12 3.01 -8.96 -0.87 0
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191596 78166394 4 OC4H5 AB4C5 -161.52 0.96 -9.98 -0.66 0
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191597 78166496 2 NO2C6H11 AB2C6D11 -204.57 5.0 -9.0 0.62 0
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191598 78166497 1 NO5C12H21 AB5C12D21 -251.08 2.55 -9.63 0.56 0
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191599 78166498 1 NO5C12H19 AB5C12D19 -228.2 5.13 -9.65 0.24 0
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191600 78166499 1 N2O3C8H12 A2B3C8D12 -125.67 5.4 -9.64 1.05 0
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191601 78166843 1 ON7C25H27 AB7C25D27 84.56 8.07 -8.97 -0.74 0
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191602 78166858 1 N3O3C23H27 A3B3C23D27 -63.08 7.78 -9.03 0.0 0
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191603 78167470 1 NS3O8C15H25 AB3C8D15E25 -341.37 2.08 -8.44 -0.7 0
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191604 78167639 1 ON2F4C17H22 AB2C4D17E22 -243.36 5.5 -8.65 -0.65 0
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191605 78168042 1 O3C15H26 A3B15C26 -158.8 3.83 -9.59 2.16 0
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191606 78168123 1 S2N7O11C20H23 A2B7C11D20E23 -324.23 12.6 -8.56 -1.37 0
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191607 78168345 1 FO3N6C27H29 AB3C6D27E29 -20.32 8.21 -8.48 -0.7 0
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191608 78168435 1 N2O2C15H22 A2B2C15D22 -80.94 2.27 -8.96 0.04 0
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191609 78168505 1 ClSF4N4O5H21C26 ABC4D4E5F21G26 -321.21 5.2 -9.19 -1.53 0
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191610 78168603 1 SN5O6C13H21 AB5C6D13E21 -137.97 4.13 -9.34 -1.14 0
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191611 78168604 1 SO6N7C14H23 AB6C7D14E23 -142.2 11.94 -9.63 -0.54 0
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191612 78168605 1 SN5O6C13H19 AB5C6D13E19 -114.81 5.01 -9.44 -1.21 0
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191613 78168606 1 SN5O6C14H21 AB5C6D14E21 -121.33 5.26 -9.3 -1.18 0
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191614 78168607 1 SN4O7C13H18 AB4C7D13E18 -158.55 5.74 -9.52 -1.24 0
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191615 78168716 1 N9O9C41H69 A9B9C41D69 -457.53 9.6 -9.43 -0.15 -1
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191616 78168732 1 PN6O16C31H46 AB6C16D31E46 -704.06 20.39 0.0 0.0 0
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191617 78168740 2 NPO6C9H12 ABC6D9E12 -642.38 3.89 -9.82 -0.38 1
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191618 78168783 1 O3N5C9H14 A3B5C9D14 -56.45 2.81 0.0 0.0 1
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191619 78168784 1 O3N4C10H15 A3B4C10D15 -83.19 3.94 0.0 0.0 1
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191620 78168785 1 BrO3N5C11H17 AB3C5D11E17 -82.29 1.87 0.0 0.0 1
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191621 78168786 1 BrO3N7C24H29 AB3C7D24E29 -0.08 6.94 0.0 0.0 0
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191622 78168974 1 ON3Cl4C5H7 AB3C4D5E7 -70.51 2.45 -10.44 -0.54 0
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191623 78169116 1 ClNO2C17H24 ABC2D17E24 -124.06 5.64 -9.6 -0.66 0
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191624 78169334 1 ON3C19H21 AB3C19D21 8.38 2.75 -8.74 -0.34 1
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191625 78169699 1 N2O3H17C20 A2B3C17D20 14.03 13.04 0.0 0.0 0
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191626 78169766 1 ClO2N4C13H13 AB2C4D13E13 -8.2 2.55 -9.61 -0.48 1
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191627 78169767 1 ClO2N5C13H19 AB2C5D13E19 -54.93 4.4 0.0 0.0 0
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191628 78169999 1 ON3C5H7 AB3C5D7 22.25 3.55 -9.64 -1.61 2
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191629 78170000 2 O4N5C11H16 A4B5C11D16 -248.63 12.24 -7.86 -1.21 1