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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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327577 126690402 1 S4N5O13H23C28 A4B5C13D23E28 -335.55 8.72 -8.88 -2.51 0
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327578 126690404 1 ON2S2C19H24 AB2C2D19E24 49.0 1.88 -8.41 -0.9 0
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327579 126690407 1 BrFSCl2O5N6C32H38 ABCD2E5F6G32H38 -89.52 4.51 -8.39 -1.07 0
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327580 126690408 1 OSN3C15H19 ABC3D15E19 34.7 2.88 -8.62 -0.51 0
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327581 126690410 1 ClFH10C11 ABC10D11 -31.43 3.14 -9.05 -0.54 0
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327582 126690411 1 NC22H25 AB22C25 19.78 2.48 -8.68 -0.47 0
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327583 126690413 1 NH13C14 AB13C14 64.61 1.62 -8.72 -0.25 0
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327584 126690414 1 OSN6C32H40 ABC6D32E40 36.02 5.33 -7.88 -0.45 0
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327585 126690415 1 ClN3O3C23H30 AB3C3D23E30 -68.23 5.01 -8.47 -0.32 0
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327586 126690416 1 SN2O2C16H20 AB2C2D16E20 -53.27 2.42 -8.79 -0.68 0
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327587 126690417 1 NC17H27 AB17C27 -8.93 2.44 -8.42 0.58 0
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327588 126690419 1 SCl2O3N8C26H30 AB2C3D8E26F30 1.66 3.99 -8.51 -1.15 0
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327589 126690421 1 N3O6C29H29 A3B6C29D29 -159.63 8.06 -8.89 -1.91 0
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327590 126690425 1 SN2O11C33H44 AB2C11D33E44 -426.72 9.87 -9.11 -0.46 0
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327591 126690428 1 NO2C20H41 AB2C20D41 -148.79 3.14 -8.96 2.33 0
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327592 126690434 1 OSN2C8H10 ABC2D8E10 0.85 1.84 -8.8 -0.8 0
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327593 126690442 1 BrNC6H10 ABC6D10 17.79 4.01 -9.59 -0.49 0
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327594 126690444 1 F3N4O6H29C34 A3B4C6D29E34 -248.32 5.65 -9.44 -1.06 0
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327595 126690451 1 ClO3N4C32H37 AB3C4D32E37 -5.06 4.37 -8.69 -0.66 0
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327596 126690459 2 F2N2O3H18C21 A2B2C3D18E21 -292.74 3.38 -9.14 -1.01 0
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327597 126690460 1 FNOC7H8 ABCD7E8 -40.42 3.23 -9.9 -0.37 0
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327598 126690468 1 NF3O5C24H30 AB3C5D24E30 -362.36 6.11 -8.58 -0.92 0
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327599 126690470 1 F3N4O7H31C36 A3B4C7D31E36 -320.24 15.23 -9.08 -1.35 0
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327600 126690473 1 N2F3O5C27H29 A2B3C5D27E29 -326.86 5.16 -8.56 -0.75 0
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327601 126690478 1 N2O3C7H10 A2B3C7D10 -74.85 1.12 -9.26 -0.51 0
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327602 126690482 1 N2F3O6H37C41 A2B3C6D37E41 -315.13 8.37 -9.04 -0.91 0
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327603 126690486 1 N4O7C39H54 A4B7C39D54 -255.96 6.17 -8.96 -0.01 0
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327604 126690489 1 BrF3N4O6C33H34 AB3C4D6E33F34 -323.65 11.68 -9.11 -0.66 0
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327605 126690491 2 NO4C18H18 AB4C18D18 -247.96 3.28 -8.99 -0.74 0
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327606 126690496 1 N2O8C41H50 A2B8C41D50 -279.59 6.2 -8.61 -0.85 0
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327607 126690500 1 IN4O7H35C40 AB4C7D35E40 -107.8 9.51 -8.85 -3.55 0
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327608 126690505 2 N2O3C20H28 A2B3C20D28 -236.63 2.48 -8.46 0.11 0
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327609 126690515 1 F6N9O12H59C71 A6B9C12D59E71 -502.55 10.34 -9.44 -1.3 0
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327610 126690517 2 SC6H6 AB6C6 40.57 3.04 -8.28 -1.3 0
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327611 126690518 2 F3N4O6H31C35 A3B4C6D31E35 -549.46 8.13 -9.25 -1.34 0
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327612 126690519 1 ClOS2N4C19H19 ABC2D4E19F19 92.6 5.79 -8.37 -1.39 0
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327613 126690521 1 Cl2N4O5H34C39 A2B4C5D34E39 -62.33 3.45 -9.02 -0.98 0
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327614 126690524 1 N3O3C30H37 A3B3C30D37 -58.6 6.23 -8.22 0.22 0
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327615 126690525 2 NOC8H9 ABC8D9 -20.35 4.86 -8.54 -0.31 0
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327616 126690526 1 N4O4C25H26 A4B4C25D26 -52.95 7.72 -9.31 -1.14 0
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327617 126690528 2 NO3C17H22 AB3C17D22 -234.37 2.72 -8.7 -0.45 0
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327618 126690529 1 N2O7C26H36 A2B7C26D36 -316.09 7.15 -8.99 -0.66 0
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327619 126690533 2 FN2O3H17C20 AB2C3D17E20 -213.24 14.28 -8.9 -0.78 0
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327620 126690537 1 N4O5C36H36 A4B5C36D36 -91.39 5.43 -9.05 -1.01 0
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327621 126690540 1 N5O5H35C39 A5B5C35D39 -80.44 8.74 -8.83 -0.71 0
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327622 126690544 1 O2N3C25H25 A2B3C25D25 15.84 6.26 -8.92 -0.54 0
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327623 126690546 1 N5O6C38H39 A5B6C38D39 -90.78 7.23 -9.1 -0.66 0
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327624 126690547 1 F3N3O4H36C42 A3B3C4D36E42 -188.5 3.65 -8.72 -0.92 0
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327625 126690550 1 OSN6C30H38 ABC6D30E38 63.75 6.7 -8.39 -0.96 0
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327626 126690555 1 SN5C28H37 AB5C28D37 46.45 4.34 -8.22 -0.6 0
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327627 126690556 2 NO2C12H15 AB2C12D15 -155.06 6.04 -9.3 -0.1 0
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327628 126690557 2 NOC12H14 ABC12D14 -45.98 2.85 -8.51 0.18 0
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327629 126690560 1 BrClSO3N5C24H25 ABCD3E5F24G25 42.41 5.33 -8.24 -1.03 0
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327630 126690561 1 IN5C14H16 AB5C14D16 98.35 3.51 -8.52 -2.45 0
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327631 126690563 1 OSCl2N4C16H22 ABC2D4E16F22 -43.2 5.07 -8.7 -0.24 0
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327632 126690566 1 ClN2C12H19 AB2C12D19 4.73 2.7 -8.84 -0.09 0
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327633 126690571 1 ION3H14C19 ABC3D14E19 92.11 2.14 -8.96 -2.66 0
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327634 126690572 1 SO3N4C20H26 AB3C4D20E26 -62.12 2.46 -9.5 -1.24 0
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327635 126690573 1 IN2O3C17H25 AB2C3D17E25 -128.61 4.22 -9.51 -1.61 0
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327636 126690575 1 N2F3O8H37C39 A2B3C8D37E39 -303.07 5.39 -9.24 -1.08 0
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327637 126690582 1 F3N4O5H37C42 A3B4C5D37E42 -234.49 8.85 -8.28 -1.0 1
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327638 126690584 1 SF2N4O4H17C19 AB2C4D4E17F19 -153.8 5.68 0.0 0.0 0
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327639 126690585 1 N2F3O6H35C40 A2B3C6D35E40 -301.55 3.59 -8.86 -0.94 0
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327640 126690592 1 N4O6C39H42 A4B6C39D42 -148.14 6.11 -8.95 -0.38 0
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327641 126690593 1 F3N5O7C44H58 A3B5C7D44E58 -402.36 7.29 -8.84 -0.53 0
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327642 126690595 1 F6N9O11H55C64 A6B9C11D55E64 -486.24 15.17 -9.29 -1.41 0
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327643 126690596 1 ON6C21H22 AB6C21D22 69.81 5.12 -9.13 -1.09 0
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327644 126690597 1 ON6C19H22 AB6C19D22 45.59 2.04 -8.7 -0.42 0
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327645 126690605 1 F3N4O6H31C35 A3B4C6D31E35 -271.79 8.63 -9.35 -1.08 0
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327646 126690612 1 SO2N5C14H15 AB2C5D14E15 4.63 6.75 -8.48 -0.45 0
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327647 126690617 1 O2N4C21H24 A2B4C21D24 3.16 3.28 -9.42 -0.84 0
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327648 126690621 1 SO3C10H16 AB3C10D16 -142.6 2.06 -8.82 0.01 0
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327649 126690627 1 ClO3N4C33H41 AB3C4D33E41 -64.31 6.49 -8.59 -0.45 0
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327650 126690634 1 NO2C19H25 AB2C19D25 -66.55 2.75 -8.16 0.27 0
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327651 126690639 1 ON2C23H30 AB2C23D30 58.49 1.48 -8.19 -0.39 0