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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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57556 22405519 1 F3N3O5C28H30 A3B3C5D28E30 -324.31 6.1 -8.61 -0.56 0
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57557 22405520 1 SF3N3O6C22H24 AB3C3D6E22F24 -376.39 7.87 -9.14 -1.15 -1
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57558 22405521 1 N2O5H21C23 A2B5C21D23 -131.6 2.24 0.0 0.0 0
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57559 22405529 1 NO4C5H7 AB4C5D7 -164.27 3.78 -10.45 -0.12 1
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57560 22407690 1 NOC2H10 ABC2D10 -32.67 4.46 0.0 0.0 0
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57561 22413691 1 SN4C7H8 AB4C7D8 115.97 2.69 -8.47 -0.5 0
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57562 22415321 1 N2O3C15H24 A2B3C15D24 -131.69 3.59 -9.7 0.46 0
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57563 22425473 1 O3N4C31H34 A3B4C31D34 -79.66 7.21 -8.02 -0.31 0
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57564 22425476 1 SN2O8C24H24 AB2C8D24E24 -274.62 4.0 -8.57 -1.58 0
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57565 22425481 1 FNSCl2O3H18C25 ABCD2E3F18G25 -94.27 1.53 -8.69 -1.04 0
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57566 22425483 1 FNSCl2O3H18C25 ABCD2E3F18G25 -88.41 3.91 -8.83 -0.84 0
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57567 22425487 1 SN2O6H14C17 AB2C6D14E17 -180.06 3.04 -8.82 -1.94 0
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57568 22425488 1 FN2O4H15C18 AB2C4D15E18 -153.79 4.75 -8.95 -2.02 0
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57569 22425490 1 ClNSF3O3H19C26 ABCD3E3F19G26 -194.49 4.72 -8.63 -1.26 0
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57570 22425494 1 NSCl2F2O3H17C25 ABC2D2E3F17G25 -142.3 4.53 -8.73 -0.99 0
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57571 22425495 1 NSCl2F2O3H17C25 ABC2D2E3F17G25 -129.38 6.64 -8.74 -1.07 0
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57572 22425497 1 ClNSO3F4H18C26 ABCD3E4F18G26 -234.17 0.93 -8.85 -1.24 0
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57573 22425498 1 ClN3C12H12 AB3C12D12 61.86 6.45 -8.82 -0.54 0
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57574 22425501 1 ClF3N3O3H13C18 AB3C3D3E13F18 -210.54 5.86 -9.31 -1.86 0
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57575 22425525 1 ClSN4C21H21 ABC4D21E21 95.51 2.06 -8.28 -0.5 0
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57576 22425527 1 ClSN2H9C11 ABC2D9E11 66.19 2.63 -8.82 -1.02 0
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57577 22425531 1 N3O5H17C19 A3B5C17D19 -107.97 2.98 -8.73 -1.58 0
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57578 22425532 1 N3O3C19H19 A3B3C19D19 -53.46 3.32 -9.2 -1.64 0
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57579 22425534 1 ON4C22H24 AB4C22D24 28.46 3.29 -8.89 -0.95 0
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57580 22425550 1 SO3N4C25H28 AB3C4D25E28 -50.25 12.36 -9.03 -0.62 0
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57581 22425559 1 SO3N4C22H22 AB3C4D22E22 -43.92 4.44 -9.2 -0.77 0
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57582 22425567 1 N3O4C17H19 A3B4C17D19 -110.47 4.02 -8.86 -0.7 0
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57583 22425568 1 O2N3C17H19 A2B3C17D19 -41.49 7.05 -8.77 -0.83 0
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57584 22425580 1 FN2S2O4C14H15 AB2C2D4E14F15 -182.48 2.02 -8.89 -0.7 0
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57585 22425581 1 ClN2O2H11C17 AB2C2D11E17 29.49 4.04 -8.44 -1.93 0
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57586 22425599 1 N5O5H23C24 A5B5C23D24 -90.61 6.26 -8.43 -1.33 0
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57587 22425604 2 ON2H6C7 AB2C6D7 1.16 2.38 -8.84 -1.25 0
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57588 22425611 1 N5O5H23C25 A5B5C23D25 -103.95 4.96 -8.94 -1.55 0
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57589 22425629 1 ClSO2N3C13H14 ABC2D3E13F14 -23.81 5.32 -9.52 -1.79 0
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57590 22425634 1 ClSN2C7H9 ABC2D7E9 30.35 2.96 -8.91 -0.98 0
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57591 22425641 1 OSN4C9H12 ABC4D9E12 22.87 2.79 -8.78 -1.1 0
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57592 22425646 1 S2N3O4C20H23 A2B3C4D20E23 -105.17 7.87 -9.4 -1.64 0
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57593 22425652 1 S2N3O5C20H25 A2B3C5D20E25 -146.91 4.91 -8.95 -1.48 0
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57594 22425654 1 ClSO2N4C20H21 ABC2D4E20F21 -6.96 10.34 -9.1 -1.18 0
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57595 22425730 1 SO2N4C23H26 AB2C4D23E26 -3.67 5.3 -8.62 -1.36 0
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57596 22425736 1 Br2N2O2H22C23 A2B2C2D22E23 -3.39 3.21 -8.95 -0.47 0
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57597 22425770 1 OCl2N6H14C18 AB2C6D14E18 105.36 3.67 -9.08 -1.88 0
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57598 22425891 1 FSO2N4C23H23 ABC2D4E23F23 -22.97 5.72 -8.99 -1.21 0
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57599 22425904 1 FOSN5H28C29 ABCD5E28F29 38.08 6.73 -8.43 -1.16 0
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57600 22425919 1 SN4O4C26H32 AB4C4D26E32 -112.99 10.85 -8.57 -0.7 0
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57601 22425928 1 ClFOSN5H23C27 ABCDE5F23G27 48.66 7.55 -8.77 -1.43 0
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57602 22425929 1 OSCl2N5H23C27 ABC2D5E23F27 82.41 7.29 -8.79 -1.27 0
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57603 22425930 1 ClFOSN5H25C28 ABCDE5F25G28 36.16 8.96 -8.79 -1.27 0
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57604 22425939 1 SO3N4H26C27 AB3C4D26E27 10.38 6.62 -8.83 -1.24 0
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57605 22426010 1 BrClFOSN4H17C22 ABCDEF4G17H22 33.98 2.67 -9.1 -1.39 0
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57606 22426140 1 N3O5H17C21 A3B5C17D21 -47.32 4.88 -7.83 -2.15 0
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57607 22426141 1 NO5H15C19 AB5C15D19 -147.17 7.67 -9.51 -1.19 0
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57608 22426142 1 NO3C17H21 AB3C17D21 -114.55 4.89 -9.16 -0.87 0
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57609 22426143 1 NO5H17C20 AB5C17D20 -142.09 9.38 -9.26 -0.94 0
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57610 22426146 1 ClSO3N4H25C28 ABC3D4E25F28 -3.69 8.15 -8.28 -1.3 0
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57611 22426147 1 SO3N4C30H30 AB3C4D30E30 -15.44 7.51 -8.57 -0.6 0
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57612 22426148 1 ClSO3N4H27C29 ABC3D4E27F29 -18.46 8.04 -8.07 -1.44 0
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57613 22426149 1 SN4O4C30H30 AB4C4D30E30 -48.44 10.65 -8.22 -1.05 0
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57614 22426150 1 FN3O4H12C19 AB3C4D12E19 -51.21 3.72 -7.9 -1.87 0
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57615 22426151 1 FN3O4H12C19 AB3C4D12E19 -49.24 7.81 -8.15 -1.78 0
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57616 22426207 1 SN5O8H19C23 AB5C8D19E23 -257.47 9.61 -9.61 -1.36 0
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57617 22426216 1 ClFSO2N4H22C27 ABCD2E4F22G27 -19.03 9.72 -8.78 -1.3 0
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57618 22426295 1 SN5O5C23H25 AB5C5D23E25 -68.81 5.89 -8.18 -1.23 0
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57619 22426296 1 ClSO2N5H26C28 ABC2D5E26F28 57.24 7.42 -8.24 -1.45 0
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57620 22426298 1 ClN3O3H16C18 AB3C3D16E18 -66.68 6.7 -8.9 -1.04 0
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57621 22426370 1 SCl2O3N4H20C23 AB2C3D4E20F23 -12.83 5.64 -9.0 -1.52 0
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57622 22426371 2 NO2C9H9 AB2C9D9 -153.42 10.95 -8.63 -1.32 0
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57623 22426432 1 FSO2N4H23C24 ABC2D4E23F24 -6.42 4.29 -8.65 -1.08 0
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57624 22426435 1 ClSO2N4C20H25 ABC2D4E20F25 -19.88 3.68 -9.04 -1.25 0
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57625 22426452 1 N2O5H24C25 A2B5C24D25 -155.25 11.81 -8.39 -1.29 0
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57626 22426946 1 SN3O3C20H23 AB3C3D20E23 -108.56 3.69 -8.72 -1.23 0
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57627 22427015 1 O2N6C25H30 A2B6C25D30 -25.11 3.41 -8.06 -0.46 0
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57628 22427255 1 FO2N5C25H32 AB2C5D25E32 -80.72 1.34 -8.57 -0.94 0
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57629 22427566 1 FO2N4C17H17 AB2C4D17E17 -11.56 3.17 -8.8 -0.66 0
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57630 22428062 1 ClSN4O5H25C26 ABC4D5E25F26 -152.38 4.81 -8.45 -1.37 0