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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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394465 135023030 1 N3O6C26H35 A3B6C26D35 -242.78 5.68 -9.49 -0.29 0
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394466 135023031 1 NSiF3O4C23H32 ABC3D4E23F32 -368.61 8.55 -9.26 -0.32 0
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394467 135023032 3 SN2O4H26C27 AB2C4D26E27 -196.0 9.13 -8.88 -0.86 0
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394468 135023033 1 BrSSiO6C27H35 ABCD6E27F35 -266.1 1.84 -9.03 -1.03 0
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394475 135023040 2 NO7C18H21 AB7C18D21 -502.58 6.19 -9.58 -0.98 1
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394476 135023041 1 N2O14C36H43 A2B14C36D43 -490.93 6.23 0.0 0.0 0
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394477 135023042 1 O13C34H42 A13B34C42 -523.24 7.07 -9.66 -0.26 0
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394478 135023043 2 O7C18H21 A7B18C21 -558.44 3.13 -9.86 -0.1 0
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394479 135023044 7 OC6H6 AB6C6 -152.48 5.3 -9.25 -0.99 0
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394480 135023045 7 OC6H6 AB6C6 -139.83 4.48 -9.11 -0.18 0
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394481 135023046 1 O7C38H40 A7B38C40 -176.06 4.05 -9.28 -0.58 0
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394482 135023063 1 NSO2C27H31 ABC2D27E31 -41.97 5.86 -9.14 -0.29 0
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394483 135023080 1 OC17H18 AB17C18 11.27 1.44 -8.63 0.29 0
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394484 135023082 2 N3O4C16H21 A3B4C16D21 -259.56 7.04 -8.59 -0.5 0
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394485 135023094 2 O3C19H20 A3B19C20 -129.44 5.54 -9.02 0.14 0
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394486 135023095 23 CH2 AB2 -82.43 0.19 -9.9 3.94 0
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394487 135023097 1 SO8H28C33 AB8C28D33 -226.08 4.05 -8.9 -0.85 0
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394489 135023100 1 N2Si2O5C19H38 A2B2C5D19E38 -299.43 2.58 -8.91 -0.71 1
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394490 135023101 1 N2Si2O5C19H39 A2B2C5D19E39 -283.71 5.15 0.0 0.0 0
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394491 135023102 1 Si2O5C19H38 A2B5C19D38 -348.98 5.77 -9.04 0.71 0
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394492 135023103 1 N2O7C20H24 A2B7C20D24 -202.5 2.85 -9.82 -1.04 0
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394493 135023106 1 NSSiO3C24H35 ABCD3E24F35 -128.97 5.53 -8.83 -0.5 0
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394494 135023109 1 F2N3H9C14 A2B3C9D14 9.32 1.89 -9.19 -0.92 0
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394496 135023111 1 NO4C17H19 AB4C17D19 -128.27 3.63 -8.94 -0.22 0
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394497 135023112 1 ClNPdO3C8H14 ABCD3E8F14 -107.67 5.94 -8.95 -0.93 0
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394498 135023113 2 N3C9H14 A3B9C14 71.43 4.86 -8.55 0.78 0
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394499 135023114 1 N6C17H26 A6B17C26 71.35 2.78 -8.34 0.5 0
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394500 135023115 1 BrN6C18H27 AB6C18D27 75.42 9.31 -8.78 0.38 0
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394501 135023116 1 OC13H20 AB13C20 -68.97 3.65 -9.54 0.88 0
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394502 135023117 1 O2C17H22 A2B17C22 29.54 3.7 -8.87 -0.04 0
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394503 135023118 2 N3C9H14 A3B9C14 52.48 6.97 -8.2 0.26 0
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394504 135023119 1 ClN2O2C19H19 AB2C2D19E19 -43.17 3.02 -8.77 -0.67 0
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394505 135023120 1 ON6C21H34 AB6C21D34 13.33 4.38 -7.78 0.55 0
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394506 135023121 1 N2O3C23H28 A2B3C23D28 -107.12 5.35 -8.07 -0.64 0
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394507 135023122 1 Al2O5C32H44 A2B5C32D44 -230.91 7.77 -8.97 -0.11 -1
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394508 135023123 1 AlO5C30H38 AB5C30D38 -162.95 5.71 0.0 0.0 0
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394510 135023125 1 O2N3C21H21 A2B3C21D21 -26.44 1.93 -8.57 -0.11 1
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394511 135023126 1 NOCl3H13C15 ABC3D13E15 1.74 3.66 0.0 0.0 0
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394512 135023127 2 OC5H7 AB5C7 -93.32 5.86 -9.86 0.15 1
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394513 135023128 1 OSiC10H19 ABC10D19 -50.81 1.87 0.0 0.0 0
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394514 135023129 1 OSiC10H20 ABC10D20 -71.73 1.5 -9.73 1.03 0
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394515 135023130 1 ClNOC21H30 ABCD21E30 -64.57 4.87 -9.3 0.21 0
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394516 135023131 1 ClNOC21H30 ABCD21E30 -64.13 5.6 -9.29 0.16 0
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394517 135023132 1 ClNOC20H28 ABCD20E28 -58.52 3.9 -9.3 0.22 0
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394518 135023133 1 N2O5C9H16 A2B5C9D16 -145.06 1.56 -10.48 -1.12 0
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394519 135023134 1 O3C15H16 A3B15C16 -68.79 5.0 -8.94 -0.05 0
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394520 135023135 1 O2H16C19 A2B16C19 2.53 3.54 -9.4 -0.67 0
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394521 135023136 1 O2H16C19 A2B16C19 0.4 4.48 -9.44 -0.9 0
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394522 135023137 1 ON2C11H18 AB2C11D18 -48.34 4.32 -9.23 1.32 0
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394523 135023138 1 NSiO3C15H27 ABC3D15E27 -179.0 1.5 -8.76 -0.03 0
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394524 135023139 2 O7C12H20 A7B12C20 -550.95 4.22 -9.19 -1.29 0
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394525 135023140 1 BrO13C30H43 AB13C30D43 -543.84 3.51 -9.68 -1.07 0
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394526 135023141 1 N2O13C30H42 A2B13C30D42 -479.86 6.05 -9.5 -0.88 1
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394527 135023142 1 N2O13C30H43 A2B13C30D43 -470.29 6.93 0.0 0.0 0
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394528 135023143 1 BrSO7C26H29 ABC7D26E29 -258.54 3.29 -9.05 -0.95 0
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394529 135023144 1 N2O13C30H42 A2B13C30D42 -473.02 4.45 -9.19 -0.69 1
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394530 135023145 1 N2O13C30H43 A2B13C30D43 -454.21 2.84 0.0 0.0 0
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394532 135023148 1 NH23C25 AB23C25 67.57 1.75 -8.69 -0.44 0
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394533 135023149 1 NH23C25 AB23C25 72.34 2.43 -8.57 -0.45 0
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394534 135023150 1 FNH18C23 ABC18D23 42.13 4.1 -9.2 -0.77 0
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394535 135023151 1 NC23H25 AB23C25 51.26 2.02 -9.26 0.06 0
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394536 135023152 1 N2O6C39H42 A2B6C39D42 -205.61 1.44 -8.7 -0.25 0
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394537 135023153 1 O3C11H14 A3B11C14 -111.72 3.71 -9.83 0.39 0
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394538 135023154 1 O2N6C23H34 A2B6C23D34 -9.04 5.59 -8.71 -0.63 0
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394539 135023155 1 O2N6C23H36 A2B6C23D36 -36.53 6.52 -8.46 0.65 0
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394540 135023156 2 ON3C13H22 AB3C13D22 -36.85 4.49 -8.44 0.65 0
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394541 135023157 1 OC33H38 AB33C38 -6.41 1.01 -8.71 -0.38 0
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394542 135023158 20 H3C5 A3B5 406.88 2.53 -7.84 -1.43 0
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394543 135023159 2 O3H8C13 A3B8C13 -144.61 9.79 -8.94 -1.46 -1
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394544 135023162 1 O8H15C23 A8B15C23 -185.0 10.29 0.0 0.0 0
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394545 135023165 1 O2C25H32 A2B25C32 -65.21 3.37 -9.13 0.66 0
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394546 135023166 1 O2C23H28 A2B23C28 -88.25 4.13 -9.23 0.57 0
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394547 135023167 1 O4C21H26 A4B21C26 -129.12 5.54 -9.64 -0.92 0
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394548 135023168 1 O4C21H36 A4B21C36 -204.98 6.1 -9.22 0.04 0
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394549 135023169 1 PSeC26H29 ABC26D29 53.91 1.19 -8.31 -0.15 0