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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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309978 126572003 1 NO3C25H35 AB3C25D35 -102.49 2.57 -8.78 0.38 0
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309979 126572031 1 O2S3N4C12H22 A2B3C4D12E22 -65.47 8.42 -8.79 -0.86 0
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309980 126572068 1 FN4O6C38H49 AB4C6D38E49 -272.23 6.21 -8.89 -0.55 0
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309981 126572100 1 FN2O5C35H45 AB2C5D35E45 -237.87 4.82 -8.76 -0.41 0
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309982 126572138 1 FN2O5C39H51 AB2C5D39E51 -239.05 4.55 -8.77 -0.4 0
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309983 126572155 2 FNO2C20H23 ABC2D20E23 -226.72 4.72 -8.87 -0.32 0
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309984 126572158 1 F2O3N4C42H56 A2B3C4D42E56 -210.26 8.33 -8.36 -0.06 0
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309985 126572202 1 FN2O5C37H49 AB2C5D37E49 -253.16 5.33 -8.59 -0.24 0
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309986 126572417 1 ClN2O2H15C16 AB2C2D15E16 -68.11 2.53 -8.92 -0.59 0
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309987 126572420 1 N2F3O3C19H19 A2B3C3D19E19 -260.18 2.4 -8.86 -0.44 0
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309988 126572459 1 NO3C7H15 AB3C7D15 -158.9 5.26 -10.21 0.9 0
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309989 126572495 1 O2N3C19H27 A2B3C19D27 -72.82 4.92 -8.07 -0.21 0
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309990 126572511 1 ClF3N3O3C21H21 AB3C3D3E21F21 -244.32 6.86 -8.9 -0.67 0
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309991 126572515 1 BrON2F3H8C10 ABC2D3E8F10 -157.55 1.57 -9.46 -0.82 0
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309992 126572525 1 O2N3C19H23 A2B3C19D23 -41.94 5.25 -8.74 -0.25 0
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309993 126572542 1 BrO2F3N3C17H19 AB2C3D3E17F19 -219.82 4.46 -9.28 -0.71 0
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309994 126572546 1 BrN2O3C12H17 AB2C3D12E17 -53.34 5.58 -9.17 -1.24 0
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309995 126572559 1 O2N3C19H27 A2B3C19D27 -69.49 4.8 -7.98 -0.12 0
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309996 126572574 1 N3O3C23H29 A3B3C23D29 -88.56 4.05 -8.82 -0.34 0
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309997 126572576 1 O2N3C17H23 A2B3C17D23 -55.64 5.2 -8.22 -0.12 0
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309998 126572583 1 OCl2N4C11H20 AB2C4D11E20 -54.36 6.42 -8.63 -0.47 0
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309999 126572604 1 FO2N8H17C19 AB2C8D17E19 -5.29 4.38 -9.06 -0.85 1
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310000 126572607 1 PN5O6C17H17 AB5C6D17E17 -166.43 7.19 0.0 0.0 1
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310001 126572616 1 PN10O13H68C76 AB10C13D68E76 -188.53 7.89 0.0 0.0 0
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310002 126572620 1 PN8O8H33C38 AB8C8D33E38 -86.19 11.2 -8.66 -1.02 0
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310003 126572623 1 O2N5H15C17 A2B5C15D17 45.11 4.95 -8.82 -1.07 0
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310004 126572634 1 ON4C19H20 AB4C19D20 51.39 3.53 -9.22 -0.59 0
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310005 126572640 1 N3H17C19 A3B17C19 95.82 4.48 -8.43 -0.86 0
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310006 126572697 1 INOF3H17C18 ABCD3E17F18 -165.36 3.89 -9.65 -1.25 0
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310007 126572708 1 N3O3C29H41 A3B3C29D41 -139.21 6.48 -8.53 -0.11 0
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310008 126572710 1 N3O3C32H47 A3B3C32D47 -152.01 1.82 -8.3 0.1 0
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310009 126572750 1 FON3C25H28 ABC3D25E28 -50.86 6.41 -9.5 -0.8 0
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310010 126572759 1 O2N3C22H25 A2B3C22D25 -65.28 5.3 -9.04 -0.66 0
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310011 126572771 1 FON3C25H28 ABC3D25E28 -50.94 5.48 -9.46 -0.8 0
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310012 126572772 1 ClON2H21C22 ABC2D21E22 4.03 2.6 -9.42 -0.69 0
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310013 126572795 1 NSO4C11H17 ABC4D11E17 -166.55 5.33 -9.64 -0.35 0
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310014 126572802 1 FON2C23H23 ABC2D23E23 -44.06 4.34 -9.54 -0.54 0
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310015 126572808 1 ClN3O3C23H26 AB3C3D23E26 -117.44 7.4 -8.85 -0.69 0
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310016 126572836 1 NO4C9H13 AB4C9D13 -112.98 5.37 -9.78 -1.09 0
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310017 126572854 1 FN3O4C22H22 AB3C4D22E22 -95.02 4.51 -9.03 -1.18 0
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310018 126572859 1 FN2O3C18H19 AB2C3D18E19 -117.82 7.74 -9.56 -1.08 0
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310019 126572862 2 O3H11C14 A3B11C14 -135.58 1.24 -8.9 -1.5 0
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310020 126572931 1 SF3O5N6C23H27 AB3C5D6E23F27 -281.12 4.91 -8.11 -1.44 0
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310021 126572935 1 FSO3N5C23H30 ABC3D5E23F30 -93.9 4.15 -7.42 -0.62 0
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310022 126572939 1 FSO3N5C22H26 ABC3D5E22F26 -64.81 5.82 -8.02 -0.81 0
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310023 126572940 1 ClFSO4N5C22H25 ABCD4E5F22G25 -157.32 4.28 -8.09 -1.29 0
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310024 126572941 1 SO3F5N6C23H27 AB3C5D6E23F27 -290.31 4.52 -8.33 -1.55 0
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310025 126572943 1 ClFSO2N6C22H24 ABCD2E6F22G24 -15.86 5.11 -7.26 -1.95 0
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310026 126572951 2 OSC5H5 ABC5D5 -37.51 5.38 -9.17 -1.66 0
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310027 126572952 1 FN2O4H7C9 AB2C4D7E9 -97.65 5.73 -9.67 -1.68 0