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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180048 76570242 1 ON4C23H26 AB4C23D26 51.42 9.83 -7.95 -1.07 0
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180049 76570251 1 FON2H15C23 ABC2D15E23 38.59 5.27 -8.53 -1.5 0
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180050 76570388 1 FO2N3C18H24 AB2C3D18E24 -104.6 3.98 -8.76 0.05 0
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180051 76570459 1 ON4C28H32 AB4C28D32 26.68 3.11 -8.81 -0.4 0
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180052 76570460 1 OF3N4C23H33 AB3C4D23E33 -201.45 4.3 -8.85 0.16 0
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180053 76570505 1 ClOSN4C27H35 ABCD4E27F35 -1.71 3.36 -8.58 -0.05 0
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180054 76570506 1 OF3N4C33H37 AB3C4D33E37 -137.01 7.16 -8.85 -0.61 0
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180055 76570526 1 OSN6C21H22 ABC6D21E22 68.97 3.94 -9.0 -0.66 0
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180056 76570527 1 O3N5C30H37 A3B5C30D37 -30.26 6.8 -8.98 -0.71 0
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180057 76570528 1 O2N4C21H30 A2B4C21D30 -47.03 2.91 -8.75 0.37 0
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180058 76570568 1 ClO2N6C26H29 AB2C6D26E29 17.54 5.32 -8.99 -1.16 0
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180059 76570626 1 ClON5C25H32 ABC5D25E32 5.72 6.59 -8.86 -0.36 0
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180060 76570627 1 O2F3N5C21H26 A2B3C5D21E26 -201.62 1.23 -9.39 -0.03 0
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180061 76570628 1 ON6C24H28 AB6C24D28 43.16 2.78 -8.52 -0.15 0
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180062 76570629 1 O2N4C23H34 A2B4C23D34 -60.32 2.87 -8.75 0.38 0
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180063 76570630 1 OF3N4C19H25 AB3C4D19E25 -171.86 3.57 -9.33 0.01 0
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180064 76570631 1 O2F4N4H26C31 A2B4C4D26E31 -162.33 4.03 -9.03 -0.66 0
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180065 76570632 1 O2F3N6C19H21 A2B3C6D19E21 -166.9 1.62 -8.77 -0.03 0
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180066 76570947 1 ON4C21H30 AB4C21D30 -17.01 3.13 -8.84 0.25 0
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180067 76571143 1 FSCl2O4N7C33H38 ABC2D4E7F33G38 -152.74 5.96 -9.03 -1.19 0
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180068 76571380 1 NO3C8H13 AB3C8D13 -133.85 3.35 -9.57 0.88 0
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180069 76571468 1 F3N9O9H34C50 A3B9C9D34E50 -86.18 12.74 -8.94 -1.83 0
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180071 76571633 1 ClNSiO4C27H42 ABCD4E27F42 -255.55 4.18 -8.85 -0.31 0
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180072 76572908 1 PO5C8H17 AB5C8D17 -238.65 3.15 -10.03 0.5 0
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180073 76572909 1 BrZnC9H11 ABC9D11 44.21 2.93 -8.42 -1.02 0
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180074 76572910 2 O2C10H11 A2B10C11 -53.67 0.91 -9.26 -0.57 0
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180075 76572911 1 O3C30H52 A3B30C52 -225.4 2.05 -9.54 0.84 0
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180076 76572912 1 FNO7C55H76 ABC7D55E76 -371.65 7.08 -8.89 -0.37 0
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180077 76572913 1 SO6C34H52 AB6C34D52 -301.06 4.04 -9.15 -0.56 0
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180078 76572990 1 FO2N6C23H29 AB2C6D23E29 -69.37 2.69 -8.31 -0.55 0
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180079 76573428 1 N4O7C17H22 A4B7C17D22 -257.77 3.7 -8.85 -0.82 0
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180080 76573641 1 N4O4H18C21 A4B4C18D21 -58.9 8.78 -9.31 -0.91 0
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180081 76573850 1 BN2O6C26H41 AB2C6D26E41 -365.69 11.52 -8.85 0.03 0
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180082 76573996 1 N2F3O6C20H25 A2B3C6D20E25 -378.15 3.45 -10.15 -1.27 0
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180083 76573997 2 NO4C11H16 AB4C11D16 -332.68 5.87 -9.78 -0.89 0
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180084 76574060 1 Cl2N2O6C21H26 A2B2C6D21E26 -227.7 2.52 -9.79 -1.2 -1
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180085 76574579 1 IrNO2C25H28 ABC2D25E28 135.19 48.22 -9.12 -6.69 0
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180086 76574831 1 O7C35H40 A7B35C40 -257.6 7.27 -8.97 -0.84 0
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180087 76575140 1 FO4C24H35 AB4C24D35 -247.28 5.19 -9.53 -0.32 0
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180088 76575141 1 ClO4C24H33 AB4C24D33 -180.74 5.91 -9.45 -0.62 0
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180089 76575142 1 NO6C21H33 AB6C21D33 -279.79 4.67 -8.9 -0.05 0
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180090 76575550 1 SN4O5C13H16 AB4C5D13E16 -74.21 10.56 -9.24 -1.82 1
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180091 76575551 1 SN4O5C13H17 AB4C5D13E17 -92.57 3.83 0.0 0.0 0
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180092 76575696 2 SN2O3C11H17 AB2C3D11E17 -179.76 5.37 -8.6 -0.83 0
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180093 76575697 1 OSN4C18H26 ABC4D18E26 -25.42 10.96 -9.25 -0.72 0
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180094 76575698 1 O2N7C28H41 A2B7C28D41 69.98 11.9 -8.02 -0.51 0
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180095 76575903 1 O3N7C28H47 A3B7C28D47 -137.65 10.69 -8.43 -0.04 1
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180096 76576226 1 O3F4N6H21C22 A3B4C6D21E22 -181.08 4.82 0.0 0.0 0
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180097 76576480 1 ClFSO3N4H20C26 ABCD3E4F20G26 -46.36 7.22 -9.31 -1.7 0
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180098 76576889 1 SO2F3N5H18C19 AB2C3D5E18F19 -147.7 5.16 -8.89 -1.54 0