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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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187053 77526477 1 BrNO4C19H24 ABC4D19E24 -157.87 3.8 -9.35 -1.04 0
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187054 77526478 1 OCl2F2N3C29H31 AB2C2D3E29F31 -96.76 3.96 -9.34 -0.66 0
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187055 77526479 1 ClON4C24H29 ABC4D24E29 14.12 9.51 -8.51 -0.87 0
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187056 77526480 2 ON3C14H14 AB3C14D14 73.21 10.06 -8.51 -1.07 0
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187057 77526629 1 ClNO7C26H36 ABC7D26E36 -349.25 10.15 -9.06 -0.67 0
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187058 77526764 1 SO5N6C33H40 AB5C6D33E40 -72.52 8.85 -8.38 -0.84 0
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187060 77527394 1 SF3N4O7C34H36 AB3C4D7E34F36 -315.04 7.03 0.0 0.0 0
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187061 77527451 1 ClSN7O10C33H36 ABC7D10E33F36 -347.91 6.64 -9.34 -1.32 -1
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187062 77527452 1 SN6O6C32H35 AB6C6D32E35 -83.26 7.75 0.0 0.0 0
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187063 77527453 1 SN6O6C32H36 AB6C6D32E36 -104.88 10.22 -8.51 -0.98 0
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187064 77527454 1 ClSN7O10C33H34 ABC7D10E33F34 -323.16 5.94 -9.47 -1.68 0
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187065 77527738 1 ClN5O6C21H28 AB5C6D21E28 -230.86 4.33 -9.52 -1.04 0
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187066 77527766 1 ClN2F3O4C15H18 AB2C3D4E15F18 -356.15 6.79 -9.2 -1.02 -1
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187067 77527833 1 SN4O5C29H31 AB4C5D29E31 -68.51 4.69 0.0 0.0 0
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187068 77527861 1 N2O8C37H60 A2B8C37D60 -409.86 1.93 -8.68 -0.25 0
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187069 77527992 1 FO3N4C21H21 AB3C4D21E21 -68.05 8.96 -8.68 -1.34 1
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187070 77528090 1 ClN4O6H28C29 AB4C6D28E29 -171.78 8.25 0.0 0.0 0
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187071 77528091 1 O2C15H20 A2B15C20 -68.2 4.81 -9.06 0.21 0
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187072 77528344 1 O3N6C24H26 A3B6C24D26 7.83 5.63 -8.42 -0.85 0
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187073 77528509 1 FN6C25H29 AB6C25D29 72.72 3.23 -8.5 -0.89 0
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187074 77529121 1 ClSO3N5C24H28 ABC3D5E24F28 -88.37 4.1 -8.99 -0.76 0
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187075 77529122 1 SO3N5C24H27 AB3C5D24E27 -49.7 2.36 -8.87 -0.69 0
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187076 77529123 1 N2O5C22H24 A2B5C22D24 -154.75 7.65 -8.49 -0.36 0
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187077 77529142 1 F3N3O5H16C21 A3B3C5D16E21 -231.19 7.68 -9.54 -1.71 0
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187078 77529244 1 O3N4C24H28 A3B4C24D28 -73.23 8.28 -8.8 -1.27 0
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187079 77529260 1 ClO8C29H39 AB8C29D39 -309.18 7.74 -8.49 -0.83 0
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187080 77529474 1 F3N5O5C23H30 A3B5C5D23E30 -333.32 3.89 -9.29 -1.27 0
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187081 77529541 1 SN4O5C34H46 AB4C5D34E46 -191.98 5.68 -9.07 -0.77 0
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187082 77529634 1 ON2C23H24 AB2C23D24 43.85 4.15 -8.76 -0.03 0
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187083 77529773 1 N4H8C11 A4B8C11 176.16 1.78 -9.25 -1.01 0
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187084 77529922 1 ClSN5O5C18H24 ABC5D5E18F24 -181.54 6.11 -8.87 -0.96 0
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187085 77529923 1 FSN2O3C21H21 ABC2D3E21F21 -103.13 1.94 -8.7 -0.35 0
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187086 77529924 1 ClNO2C12H18 ABC2D12E18 -93.53 2.9 -8.78 -0.08 0
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187087 77529982 1 O2N3H21C23 A2B3C21D23 7.04 6.01 -9.33 -1.22 0
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187088 77529983 1 ClSF2O3N4C21H25 ABC2D3E4F21G25 -198.15 4.81 -9.63 -0.87 0
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187089 77529984 1 SN4O7C20H28 AB4C7D20E28 -268.33 7.24 -9.29 -0.94 0
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187090 77529985 1 SN4O6C20H30 AB4C6D20E30 -230.82 5.32 -9.28 -0.99 0
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187091 77529986 1 ClNO3C12H16 ABC3D12E16 -119.4 1.96 -8.93 -0.12 0
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187092 77529987 1 NO5C43H77 AB5C43D77 -293.77 6.55 -8.5 0.2 0
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187093 77529988 1 FSCl2O4N7C18H18 ABC2D4E7F18G18 -116.06 6.08 -8.42 -0.6 0
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187094 77529989 1 ClFSO4N6C22H24 ABCD4E6F22G24 -138.47 6.73 -8.65 -1.03 0
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187095 77529990 1 SCl2N5O6C20H21 AB2C5D6E20F21 -137.59 6.15 -8.49 -0.77 0
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187096 77530088 1 ClSF4N5O7C21H26 ABC4D5E7F21G26 -484.13 4.26 -8.96 -1.39 0
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187097 77530089 1 ClFSN5O5C19H25 ABCD5E5F19G25 -232.11 9.28 -8.61 -1.49 0
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187098 77530332 1 NC29H49 AB29C49 -72.13 2.24 -8.98 1.57 0
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187099 77530333 1 NC29H49 AB29C49 -75.57 2.57 -9.07 1.46 0
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187100 77530334 1 SCl2O5N6C21H22 AB2C5D6E21F22 -127.61 2.2 -8.82 -1.27 0
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187101 77530335 1 ClSO5N7H20C21 ABC5D7E20F21 -82.36 9.42 -8.65 -1.09 0
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187102 77530336 1 FSCl2O4N6C19H19 ABC2D4E6F19G19 -141.95 4.59 -8.15 -0.53 0
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187103 77530337 1 FSCl2N5O5C23H24 ABC2D5E5F23G24 -186.99 4.71 -8.5 -0.72 0