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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179484 76489331 1 O2S2N3C28H41 A2B2C3D28E41 -59.63 0.92 -8.67 0.01 0
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179485 76489652 1 S3N9O12H23C28 A3B9C12D23E28 -257.44 3.07 -9.2 -1.66 0
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179486 76489668 1 PSSiN2O7C39H47 ABCD2E7F39G47 -255.39 9.19 -8.57 -0.51 0
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179487 76490242 1 SN2C5H6 AB2C5D6 59.68 2.89 -9.06 -0.67 0
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179488 76490243 1 ClSN3O5C21H28 ABC3D5E21F28 -161.49 2.64 -8.76 -0.33 0
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179489 76490244 1 O5C22H30 A5B22C30 -206.2 5.17 -9.73 -0.39 0
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179490 76490583 1 Cl2N3O4H25C29 A2B3C4D25E29 -73.56 5.24 -9.7 -1.64 1
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179491 76490584 1 O2N4C12H23 A2B4C12D23 -34.4 2.1 0.0 0.0 0
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179492 76490585 1 ClSO2N3H12C15 ABC2D3E12F15 16.91 1.57 -9.36 -1.52 0
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179493 76490586 1 FNO5C22H32 ABC5D22E32 -304.33 1.66 -9.66 -0.16 0
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179494 76490587 1 O3N6C38H52 A3B6C38D52 -72.74 5.92 -8.15 -0.36 0
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179495 76490588 1 S2N7O12C19H19 A2B7C12D19E19 -286.42 3.86 -9.42 -1.72 0
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179496 76490589 1 NSO5C19H27 ABC5D19E27 -203.0 2.98 -9.02 -0.4 0
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179497 76490590 1 ClON4C17H21 ABC4D17E21 24.73 2.85 -8.73 -0.18 0
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179498 76490591 1 O6C25H36 A6B25C36 -292.47 9.94 -10.16 -0.65 0
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179499 76490592 1 OSC13H22 ABC13D22 -66.01 3.16 -8.62 0.54 0
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179500 76490593 1 Si2O6C43H82 A2B6C43D82 -487.18 2.05 -8.72 1.17 -1
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179501 76490594 1 SO5C7H7 AB5C7D7 -165.28 2.47 0.0 0.0 0
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179502 76490595 1 SO5C7H8 AB5C7D8 -187.43 4.08 -9.84 -1.43 0
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179503 76490596 1 NSO3C25H35 ABC3D25E35 -150.0 3.43 -9.62 0.06 0
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179504 76490597 1 NO2C26H41 AB2C26D41 -133.08 8.01 -9.05 0.22 0
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179505 76490677 1 NCl2O8C40H47 AB2C8D40E47 -252.64 5.89 -8.61 -0.13 0
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179506 76490678 1 NO4C32H45 AB4C32D45 -137.63 4.37 -8.69 0.08 0
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179507 76490871 1 O3S3N9C18H25 A3B3C9D18E25 60.52 9.15 -9.6 -1.38 0
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179508 76491446 1 N5O8C28H35 A5B8C28D35 -266.24 5.96 -9.58 -0.82 0
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179509 76491490 1 SN7O9H33C42 AB7C9D33E42 -36.86 10.6 -9.31 -1.43 0
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179510 76491491 1 F2O5C25H40 A2B5C25D40 -359.9 2.59 -9.24 0.43 0
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179511 76491505 1 FNO4C19H26 ABC4D19E26 -209.44 1.7 -8.83 0.21 0
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179512 76491727 1 N3O3C20H21 A3B3C20D21 -60.49 2.45 -8.98 -1.02 0
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179513 76491790 1 NSO3C11H15 ABC3D11E15 -74.73 1.46 -9.97 -0.48 0
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179514 76491791 1 SCl2N3O6C34H39 AB2C3D6E34F39 -186.13 7.56 -8.06 -0.98 0
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179515 76491873 1 O3N6C48H56 A3B6C48D56 14.45 12.47 -8.45 -0.71 0
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179516 76491874 1 SSiN4O11C33H42 ABC4D11E33F42 -287.21 10.61 -9.02 -1.53 0
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179517 76492518 1 O6C13H18 A6B13C18 -261.39 3.02 -9.56 0.17 0
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179518 76492709 1 SN3O8C26H31 AB3C8D26E31 -267.33 6.41 -9.27 -0.85 0
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179519 76492811 2 OC10H14 AB10C14 -110.99 4.78 -9.85 -0.12 0
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179520 76492978 1 O2N6H34C35 A2B6C34D35 33.9 4.87 -8.91 -0.65 0
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179521 76493488 1 NO7C23H35 AB7C23D35 -320.24 5.99 -9.32 -0.1 0
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179522 76493718 1 FPO9C24H28 ABC9D24E28 -471.6 2.72 -9.32 0.08 0
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179523 76493719 2 NO4C14H16 AB4C14D16 -281.89 7.85 -8.97 -0.46 0
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179524 76493720 1 O7C8H12 A7B8C12 -299.51 2.04 -10.75 -0.58 0
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179525 76493907 1 O5C23H34 A5B23C34 -271.5 3.18 -9.82 0.55 0
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179526 76494125 1 NO5C7H13 AB5C7D13 -227.82 2.04 -10.17 0.19 0
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179527 76494126 1 NO6C14H25 AB6C14D25 -306.14 2.41 -9.98 -0.28 0
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179528 76494193 1 NSO3C31H43 ABC3D31E43 -95.19 4.86 -8.63 -0.42 0
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179529 76494290 1 NOPC11H16 ABCD11E16 -26.0 2.76 -8.61 0.24 0
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179530 76494291 1 O3N5C15H23 A3B5C15D23 -89.44 2.65 -8.98 -0.4 0
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179531 76494597 2 NOC12H20 ABC12D20 -85.8 4.4 -8.76 0.85 0
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179532 76494598 1 OF2N4C10H10 AB2C4D10E10 -42.87 5.95 -9.93 -1.54 0
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179533 76494844 1 S3O7N9H17C20 A3B7C9D17E20 -63.2 15.38 -9.49 -1.81 0