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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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15926 455295 1 N5O6C31H49 A5B6C31D49 -280.3 7.69 -8.99 -0.12 0
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15927 455305 2 ClO5C23H25 AB5C23D25 -334.04 14.87 -8.89 -1.54 0
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15928 455313 1 O4H10C15 A4B10C15 -84.81 5.98 -8.91 -0.73 0
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15929 455469 1 ClON3H14C18 ABC3D14E18 76.01 2.45 -9.05 -0.9 0
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15930 455478 1 ClOSN3H12C16 ABCD3E12F16 82.25 1.02 -9.07 -1.15 0
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15931 455495 1 N3O5C28H43 A3B5C28D43 -244.86 3.23 -8.99 0.02 0
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15932 455524 1 O5C23H24 A5B23C24 -163.84 3.85 -8.6 -0.69 0
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15933 455601 1 PSN3O7C14H22 ABC3D7E14F22 -347.69 6.2 -9.23 -0.33 0
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15934 455602 1 PSN3O7C10H14 ABC3D7E10F14 -333.63 4.19 -9.79 -0.83 0
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15935 455624 2 NS2O7H10C14 AB2C7D10E14 -455.49 4.06 -9.61 -2.01 0
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15936 455679 1 N2O2C15H18 A2B2C15D18 -49.6 7.44 -9.72 -0.23 0
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15937 455686 1 N2O2C13H14 A2B2C13D14 -38.17 6.61 -9.4 -0.19 0
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15938 455696 2 NOC8H10 ABC8D10 -60.48 6.65 -9.34 -0.09 0
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15939 455701 1 O4C15H16 A4B15C16 -138.15 2.95 -9.35 -0.59 0
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15940 455702 1 O3C13H14 A3B13C14 -106.25 5.48 -9.18 -0.59 0
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15941 455714 1 N3O6C36H41 A3B6C36D41 -184.0 3.01 -9.28 -0.09 0
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15942 455715 1 N3O6C28H41 A3B6C28D41 -270.21 3.11 -9.54 0.09 0
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15943 455726 1 N2O2C25H42 A2B2C25D42 -125.16 3.69 -9.09 0.18 0
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15944 455803 1 PN3O8C19H24 AB3C8D19E24 -379.61 10.71 -9.76 -0.29 0
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15945 455813 1 ClO7H25C26 AB7C25D26 -268.56 4.87 -9.29 -1.1 0
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15946 455899 1 O9C36H50 A9B36C50 -431.59 3.46 -9.16 -0.98 0
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15947 455915 1 FN2O2C29H41 AB2C2D29E41 -131.63 4.28 -7.93 -0.48 0
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15948 456062 1 S2O5N6C38H56 A2B5C6D38E56 -240.67 7.04 -9.1 -0.33 0
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15949 456120 1 SN5O6H27C28 AB5C6D27E28 -135.76 7.2 -8.71 -1.98 0
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15950 456134 4 N2C4H5 A2B4C5 85.58 5.67 -8.17 -0.48 0
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15951 456186 1 ClN4H9C12 AB4C9D12 59.84 2.57 -8.62 -0.99 0
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15953 456227 1 SN5C16H17 AB5C16D17 73.43 3.85 -8.32 -0.35 0
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15954 456271 1 FO3N4C17H19 AB3C4D17E19 -113.52 13.63 -9.18 -1.08 0
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15955 456272 1 SN5H17C19 AB5C17D19 102.51 6.21 -8.73 -0.83 0
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15956 456383 1 BrN4H22C23 AB4C22D23 117.77 2.27 0.0 0.0 1
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15957 456469 1 N3O4C16H37 A3B4C16D37 -226.1 4.15 -9.06 0.26 0
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15959 456503 1 N10O18C55H90 A10B18C55D90 -871.36 8.55 -8.97 -0.52 0
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15960 456536 1 ClSO5N7C20H22 ABC5D7E20F22 -127.87 5.92 -9.31 -0.81 0
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15961 456546 1 SO6N7C20H23 AB6C7D20E23 -160.75 3.11 -8.74 -0.95 0
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15962 456552 1 N5O27C68H91 A5B27C68D91 -1081.28 7.85 -8.98 -1.64 0
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15963 456553 1 O17C47H64 A17B47C64 -683.15 7.62 -9.16 -0.91 0
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15964 456555 1 N5O27C67H89 A5B27C67D89 -1086.46 4.08 -9.18 -1.16 0
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15965 456591 1 N5O13C22H43 A5B13C22D43 -595.09 9.25 -9.29 0.33 0
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15966 456598 1 ON5C11H15 AB5C11D15 7.88 3.97 -8.86 -0.38 0
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15967 456602 1 SN5O5C31H41 AB5C5D31E41 -176.75 8.56 -9.39 -0.48 0
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15968 456606 2 N4C12H13 A4B12C13 122.44 0.48 -9.01 -0.53 0
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15969 456608 4 NOC5H6 ABC5D6 -46.12 3.86 -8.65 -0.27 0
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15970 456609 1 ClN3O3C24H26 AB3C3D24E26 -79.59 3.29 -8.78 -1.02 0
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15971 456623 1 SO2C26H44 AB2C26D44 -138.84 5.42 -8.34 0.89 0
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15972 456665 1 N3O3C11H13 A3B3C11D13 -77.73 3.03 -9.71 -0.99 0
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15973 456754 1 ClN2O2H11C14 AB2C2D11E14 -8.48 5.72 -8.93 -0.73 0
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15974 456841 1 Cl2N9O14C47H55 A2B9C14D47E55 -500.29 6.27 -9.06 -1.05 0
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15975 456861 1 SN6O14C48H82 AB6C14D48E82 -640.92 12.54 -8.58 -0.35 0
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15976 456862 1 NO13C33H47 AB13C33D47 -517.52 2.48 -9.01 -0.69 0
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15977 456971 1 Cl2N3C18H23 A2B3C18D23 22.86 2.71 -8.28 -0.84 0