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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191071 78101692 1 ClNSO2H10C12 ABCD2E10F12 -24.97 5.46 -9.29 -1.1 0
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191072 78101994 1 NC26H33 AB26C33 40.61 2.25 -8.75 0.46 0
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191073 78102021 1 ClNC24H28 ABC24D28 47.9 2.14 -8.9 -0.36 0
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191074 78102312 1 SiO6N8C45H58 AB6C8D45E58 -216.34 4.78 -8.54 -0.73 0
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191075 78102313 1 ClSiO6N8C44H53 ABC6D8E44F53 -184.33 7.36 -8.56 -0.56 0
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191076 78102314 1 SiO4N6C40H48 AB4C6D40E48 -118.39 8.89 -8.26 -0.35 0
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191077 78102315 1 SiN6C30H32 AB6C30D32 110.92 7.96 -8.33 -0.49 0
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191078 78102316 1 NO7C32H33 AB7C32D33 -167.68 7.69 -8.52 -0.93 0
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191079 78102317 1 N4O5H24C25 A4B5C24D25 -132.75 8.4 -8.91 -1.21 0
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191080 78102322 1 SO3N4C24H34 AB3C4D24E34 -93.95 8.09 -9.31 0.1 0
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191081 78102415 1 ClN4O4C24H29 AB4C4D24E29 -58.04 12.37 -8.94 -1.31 0
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191082 78102491 1 N2O5H34C35 A2B5C34D35 -110.32 7.0 -8.11 -0.46 0
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191083 78102707 1 OSN10C21H30 ABC10D21E30 44.84 2.84 -8.9 -0.41 0
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191084 78102716 1 F3N4O4H23C29 A3B4C4D23E29 -231.43 5.65 -9.37 -1.41 0
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191085 78102717 1 ClF3N4O4H22C29 AB3C4D4E22F29 -238.8 5.39 -9.43 -1.44 0
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191086 78102718 1 PN4O5C20H25 AB4C5D20E25 -225.91 4.82 -9.94 -0.51 0
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191087 78102782 1 N2O5C31H32 A2B5C31D32 -119.82 5.34 -8.16 -0.7 0
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191088 78102954 1 N3O6C41H47 A3B6C41D47 -219.44 5.94 -9.28 -0.16 0
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191090 78103013 1 PCl2N3O4C64H102 AB2C3D4E64F102 -256.53 6.48 -8.06 0.4 0
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191091 78103079 3 NO2C9H11 AB2C9D11 -219.99 3.52 -9.16 -0.2 0
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191094 78103082 1 F3N17O17C75H126 A3B17C17D75E126 -981.94 14.48 -9.3 -0.58 0
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191095 78103142 1 ClOF3N4H10C17 ABC3D4E10F17 -58.54 3.18 -9.75 -2.74 0
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191096 78103143 1 ClOF3N4H12C18 ABC3D4E12F18 -68.61 2.69 -9.71 -2.7 0
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191097 78103144 1 FON4C17H23 ABC4D17E23 -53.65 1.66 -9.2 -0.65 0
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191098 78103564 1 INSeO2C15H16 ABCD2E15F16 -56.69 2.24 -9.01 -1.1 0
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191099 78103565 1 NSeO5C22H25 ABC5D22E25 -201.26 2.5 -8.95 -0.77 0
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191100 78103566 1 NO2H21C24 AB2C21D24 -14.1 3.33 -8.69 -0.65 0
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191101 78103629 1 ClN4O4H21C24 AB4C4D21E24 -98.9 10.16 -9.11 -1.22 0
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191102 78103860 1 N5O7H39C40 A5B7C39D40 -65.55 4.44 -8.71 -0.94 0
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191103 78103963 1 ON4C21H32 AB4C21D32 -19.29 3.48 -8.94 0.25 0
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191104 78104305 3 OC5H8 AB5C8 -138.55 2.49 -9.31 0.39 0
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191105 78104736 1 ON9C20H27 AB9C20D27 39.39 4.41 -8.55 -0.82 0
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191106 78105472 1 N5O9C25H37 A5B9C25D37 -278.87 4.76 -8.91 -1.24 0
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191107 78105473 1 P3N5O18C25H36 A3B5C18D25E36 -817.42 7.42 -8.71 -1.16 0
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191108 78105474 1 N3O9C22H31 A3B9C22D31 -322.51 5.88 -9.88 -1.37 1
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191109 78105475 1 ClSN5O9C28H35 ABC5D9E28F35 -258.27 37.75 0.0 0.0 0
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191110 78105476 1 N2O5H32C38 A2B5C32D38 -68.03 6.78 -9.07 -1.32 0
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191111 78105533 1 P3S3N8O25C48H49 A3B3C8D25E48F49 -1012.56 15.32 -8.89 -2.0 0
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191112 78105746 1 N2O5H22C27 A2B5C22D27 -91.39 2.62 -9.19 -0.35 0
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191113 78105911 1 NO4H15C17 AB4C15D17 -105.37 4.6 -8.94 -1.08 0
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191114 78106439 1 O5C15H22 A5B15C22 -246.18 5.88 -10.57 -0.28 0
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191115 78106440 1 O4C15H22 A4B15C22 -202.0 7.24 -9.87 0.37 0
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191116 78106569 1 NO6C29H35 AB6C29D35 -203.47 5.33 -8.98 -0.69 0
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191117 78106570 1 NO6C31H39 AB6C31D39 -142.92 16.04 -7.46 -0.45 0
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191118 78106571 1 NO6C31H37 AB6C31D37 -177.56 5.69 -8.95 -0.66 0
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191119 78106572 1 NO6C32H39 AB6C32D39 -184.77 5.26 -8.72 -0.68 0
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191120 78106573 1 NO7C31H37 AB7C31D37 -213.45 2.77 -8.78 -0.67 0
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191121 78106915 1 Si6O15C88H160 A6B15C88D160 -1051.99 4.13 -9.3 -0.9 0
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191122 78107270 1 ON9C20H25 AB9C20D25 62.97 6.01 -8.8 -0.97 0
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191123 78107337 1 SN5O7C11H19 AB5C7D11E19 -233.86 5.93 -9.79 -1.33 0