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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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406431 135077550 1 N2O4C15H17 A2B4C15D17 -85.67 6.65 0.0 0.0 0
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406432 135077553 1 OSiS2C22H24 ABC2D22E24 -22.05 2.26 -8.37 -0.36 0
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406434 135077580 1 O2N6C11H18 A2B6C11D18 -23.98 4.06 -9.85 -0.54 0
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406435 135077582 1 ClN3C21H24 AB3C21D24 86.95 19.51 -6.84 -1.55 0
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406436 135077583 1 ClO2N6C15H17 AB2C6D15E17 5.63 3.16 -9.93 -0.77 0
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406437 135077594 1 LiZnCl3O4C24H28 ABC3D4E24F28 -50.78 12.49 -8.03 -1.54 0
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406439 135077606 1 NSO4C13H13 ABC4D13E13 -122.68 7.27 -8.75 -0.59 0
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406440 135077609 1 SN2F3O3C10H13 AB2C3D3E10F13 -265.57 9.08 -8.84 -0.72 0
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406441 135077643 1 NSF3O3H14C16 ABC3D3E14F16 -191.6 5.92 -8.78 -0.94 0
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406442 135077654 1 N2O4C35H36 A2B4C35D36 -74.22 7.94 -8.99 -0.33 0
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406443 135077655 1 N4O5C40H44 A4B5C40D44 -130.49 6.21 -9.42 -0.35 0
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406444 135077656 2 NO2C10H10 AB2C10D10 -104.62 3.36 -9.62 -0.48 1
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406445 135077657 1 NO2C10H10 AB2C10D10 -10.84 1.3 0.0 0.0 0
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406446 135077658 2 NOC6H7 ABC6D7 -67.8 4.83 -8.26 -0.1 0
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406447 135077659 1 SiO2C8H16 AB2C8D16 -19.72 2.8 -8.87 0.02 0
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406448 135077660 1 LiMgCl2H5C6 ABC2D5E6 -80.55 6.57 -9.69 -0.82 0
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406449 135077661 1 FNSO4C19H20 ABCD4E19F20 -127.78 3.47 -9.44 -0.54 0
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406450 135077662 1 BrNSO12C26H32 ABCD12E26F32 -513.56 8.79 -8.97 -1.0 0
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406451 135077663 1 ClNSO12C26H32 ABCD12E26F32 -527.81 8.06 -8.91 -0.52 0
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406452 135077664 1 FNSO11C24H30 ABCD11E24F30 -529.66 1.38 -9.04 -0.51 0
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406453 135077665 4 OC3H5 AB3C5 -194.55 4.25 -9.93 0.31 0
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406454 135077666 2 O3C7H11 A3B7C11 -272.92 6.94 -10.0 0.31 0
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406455 135077667 1 ClO2C16H29 AB2C16D29 -147.83 2.7 -9.91 0.49 0
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406456 135077668 1 SiO5C20H32 AB5C20D32 -220.14 3.5 -8.7 0.56 0
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406457 135077669 1 O4C11H18 A4B11C18 -186.83 2.99 -9.64 0.14 0
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406458 135077670 1 SiO4C19H28 AB4C19D28 -209.19 2.39 -8.95 -1.35 0
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406459 135077671 1 NO2C16H21 AB2C16D21 -83.57 2.36 -9.66 0.07 0
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406460 135077672 1 NO2C22H25 AB2C22D25 -58.5 2.37 -9.48 0.05 0
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406461 135077673 1 NS2O6C30H31 AB2C6D30E31 -149.85 4.47 -8.88 -0.91 0
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406462 135077674 1 ClSeO8C20H27 ABC8D20E27 -321.91 4.63 -8.6 -0.38 0
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406463 135077675 1 SO7C27H30 AB7C27D30 -207.06 4.85 -9.38 -0.06 0
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406464 135077676 1 SO7C27H30 AB7C27D30 -206.49 5.69 -9.64 -0.12 0
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406465 135077677 1 SO7C27H30 AB7C27D30 -205.82 2.86 -9.3 -0.13 0
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406466 135077678 1 SiO3C16H32 AB3C16D32 -201.1 2.47 -9.04 0.22 0
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406467 135077679 1 N2O3F5H17C22 A2B3C5D17E22 -249.12 4.24 -8.9 -1.79 0
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406468 135077680 1 NOH11C13 ABC11D13 41.36 0.59 -8.8 -0.42 0
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406469 135077681 1 NSO2C18H21 ABC2D18E21 -48.95 4.75 -9.51 -0.16 0
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406470 135077682 1 SN2O4C16H16 AB2C4D16E16 -40.28 5.86 -9.78 -1.73 0
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406471 135077683 1 CrFO5C13H13 ABC5D13E13 -319.34 5.22 -10.0 -1.41 0
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406472 135077686 1 CrNO4H17C24 ABC4D17E24 -12.89 4.69 -7.16 -1.03 0
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406473 135077690 1 ClOSN2C11H13 ABCD2E11F13 25.86 5.21 -8.74 -0.5 0
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406474 135077722 1 NO3C20H23 AB3C20D23 -91.42 3.65 -9.4 0.14 0
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406475 135077726 1 ClON2F5H12C16 ABC2D5E12F16 -252.62 7.11 -9.8 -1.87 0
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406476 135077732 2 SO3C7H11 AB3C7D11 -229.83 4.09 -9.05 -0.81 0
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406477 135077738 1 NNaSO10C16H24 ABCD10E16F24 -433.28 17.03 -9.89 -0.46 0
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406478 135077741 1 SN3O5H19C21 AB3C5D19E21 -29.46 7.48 -9.16 -1.36 0
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406479 135077750 2 OC7H11 AB7C11 -109.26 3.49 -9.8 0.55 0
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406480 135077752 1 NO4C16H19 AB4C16D19 -128.71 5.43 -9.19 -0.4 0
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406481 135077755 1 NO3C15H23 AB3C15D23 -110.15 4.6 -10.05 0.06 0
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406482 135077800 1 ON2C17H34 AB2C17D34 -84.07 2.43 -9.57 0.85 0