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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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80472 49834619 1 ClOSF2N3C14H14 ABCD2E3F14G14 -95.73 4.4 -9.34 -1.04 0
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80473 49834633 1 SO2N5H21C22 AB2C5D21E22 40.86 2.85 -8.62 -1.0 0
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80474 49834635 1 OSN3H21C25 ABC3D21E25 81.24 2.94 -8.5 -0.62 0
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80475 49834648 1 S2N6O9C37H46 A2B6C9D37E46 -293.03 7.55 -9.2 -1.49 0
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80476 49834649 1 FSN6O9C38H45 ABC6D9E38F45 -297.39 11.11 -9.26 -1.03 0
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80477 49834652 1 N7O13C24H49 A7B13C24D49 -571.34 7.86 -9.33 -0.04 0
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80478 49834654 2 N2O7C12H24 A2B7C12D24 -655.84 5.98 -9.31 0.39 0
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80479 49834655 1 IN4O4C29H35 AB4C4D29E35 -62.67 16.14 -8.05 -0.88 1
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80480 49834662 1 N3O4C35H40 A3B4C35D40 -89.24 4.23 0.0 0.0 1
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80481 49834664 1 BrN3O4C30H35 AB3C4D30E35 -102.5 4.02 0.0 0.0 0
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80482 49834673 1 NOSC17H25 ABCD17E25 -23.06 3.81 -9.04 -0.4 0
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80483 49834680 1 FO2N4C26H29 AB2C4D26E29 -86.98 4.55 -8.77 -0.1 0
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80484 49834692 3 NOC8H11 ABC8D11 -65.75 3.6 -8.77 0.16 0
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80485 49834696 1 Cl2O3N5H25C29 A2B3C5D25E29 3.66 7.76 -8.77 -0.5 0
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80486 49834701 1 SO2N7H25C32 AB2C7D25E32 115.42 9.07 -8.7 -1.03 0
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80487 49834709 1 SO3N4C22H24 AB3C4D22E24 -48.53 9.58 -8.64 -0.26 0
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80488 49834725 1 SO3F4N5C25H25 AB3C4D5E25F25 -243.07 8.42 -8.95 -1.15 0
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80489 49834729 1 FN2S2O5C25H25 AB2C2D5E25F25 -187.36 7.37 -9.62 -1.04 0
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80490 49834730 1 FSN3O5H22C24 ABC3D5E22F24 -106.97 8.47 -9.65 -1.37 0
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80491 49834731 1 BrFSN2O3H22C24 ABCD2E3F22G24 -100.25 6.59 -8.94 -0.92 0
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80492 49834734 1 O4C33H66 A4B33C66 -320.58 3.85 -10.22 0.51 0
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80493 49834737 1 BF3O4C17H20 AB3C4D17E20 -386.39 7.13 -10.02 -0.86 0
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80494 49834740 1 NO2F3C28H30 AB2C3D28E30 -213.7 4.23 -8.71 -0.49 0
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80495 49834768 1 FN2O2H15C17 AB2C2D15E17 -65.03 5.48 -8.74 -1.0 0
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80496 49834769 1 FN2O2C23H25 AB2C2D23E25 -83.98 5.87 -8.68 -0.96 0
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80497 49834771 1 FN2O2H19C20 AB2C2D19E20 -73.98 6.67 -8.53 -0.82 0
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80498 49834777 1 F2O3N6H20C21 A2B3C6D20E21 -69.91 7.13 -8.51 -1.14 0
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80499 49834779 1 F2O4N5H17C20 A2B4C5D17E20 -106.06 4.84 -9.12 -1.24 0
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80500 49834781 1 N2S2O11C19H22 A2B2C11D19E22 -455.26 8.62 -9.26 -1.24 0
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80501 49834791 1 NOBr2H9C15 ABC2D9E15 32.64 2.76 -9.12 -1.23 0
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80502 49834804 1 SO2F3N3C16H18 AB2C3D3E16F18 -183.03 4.79 -9.21 -0.86 0
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80503 49834806 1 OSF3N4C15H17 ABC3D4E15F17 -140.63 6.04 -9.3 -0.98 0
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80504 49834812 1 SO2F3N3H14C15 AB2C3D3E14F15 -174.56 5.6 -9.42 -1.22 0
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80505 49834819 1 SO2N4C22H22 AB2C4D22E22 5.69 2.17 -8.41 -0.61 0
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80506 49834823 1 BN2O5C18H19 AB2C5D18E19 -224.1 5.97 -9.36 -1.0 0
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80507 49834833 1 FN2O5C23H31 AB2C5D23E31 -197.28 9.1 -8.95 -0.35 0
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80508 49834840 1 N5O15C24H47 A5B15C24D47 -689.59 2.04 -9.38 0.14 0
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80509 49834841 1 F2N5O13C24H45 A2B5C13D24E45 -667.19 5.71 -9.38 0.25 0
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80510 49834846 1 IN3O5C32H40 AB3C5D32E40 -32.37 7.9 -8.13 -1.38 1
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80511 49834847 1 N3O5C32H40 A3B5C32D40 -148.48 4.55 0.0 0.0 0
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80512 49834862 1 NO2C18H31 AB2C18D31 -121.97 4.15 -9.49 -0.42 0
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80513 49834875 1 SF2O6C34H34 AB2C6D34E34 -291.43 10.98 -9.59 -1.0 0
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80514 49834893 1 SN4O5C27H36 AB4C5D27E36 -163.33 10.21 -8.04 -0.52 0
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80515 49834895 1 SN3O4C25H31 AB3C4D25E31 -119.36 8.17 -8.34 -0.71 0
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80516 49834897 1 ClON7H22C23 ABC7D22E23 66.79 0.28 -8.67 -1.12 0
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80517 49834898 1 ClON7H22C23 ABC7D22E23 75.91 1.8 -8.6 -1.11 0
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80518 49834900 1 O2N7C24H25 A2B7C24D25 29.58 2.92 -8.54 -1.18 0
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80519 49834904 1 SN3O5C22H27 AB3C5D22E27 -152.21 4.78 -9.79 -0.73 0
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80520 49834912 1 N2F3O3H19C20 A2B3C3D19E20 -180.41 1.78 -8.39 -0.67 0
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80521 49834917 1 ON6C25H26 AB6C25D26 103.64 4.42 -9.22 -0.92 0