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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222576 85305555 1 NO4C22H31 AB4C22D31 -186.99 7.55 -9.52 -0.1 0
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222577 85305557 1 NSiO5C18H35 ABC5D18E35 -220.55 6.32 -8.62 -0.76 0
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222578 85305558 1 NSiO4C19H39 ABC4D19E39 -300.45 3.54 -9.01 0.86 0
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222579 85305559 1 ClNO5H16C19 ABC5D16E19 -57.49 5.62 -9.32 -1.16 0
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222580 85305564 2 O4C9H15 A4B9C15 -349.36 5.15 -9.57 -0.32 0
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222581 85305565 1 SiF3O4C17H21 AB3C4D17E21 -352.57 6.37 -9.88 -0.45 0
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222582 85305566 1 O6C21H26 A6B21C26 -101.81 5.07 -8.9 0.08 0
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222583 85305567 1 N2O5C20H26 A2B5C20D26 -173.62 2.83 -8.31 -0.66 0
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222584 85305569 2 O3C10H19 A3B10C19 -313.3 2.92 -9.46 1.78 0
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222585 85305571 1 N2O3C22H34 A2B3C22D34 -95.5 2.89 -8.7 0.06 0
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222586 85305572 1 SO3C22H30 AB3C22D30 -142.35 0.75 -8.55 -0.04 0
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222587 85305573 1 ClO3N4C18H19 AB3C4D18E19 -36.53 2.22 -9.37 -0.99 0
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222588 85305574 1 Cl2N2O4H8C17 A2B2C4D8E17 -87.94 9.58 -9.48 -2.22 0
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222589 85305575 1 N3O6C18H23 A3B6C18D23 -249.82 3.8 -9.78 -0.18 0
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222590 85305578 1 NSiO4C20H29 ABC4D20E29 -165.66 6.02 -9.45 0.09 0
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222591 85305579 1 ClNO3F6H8C13 ABC3D6E8F13 -356.69 3.69 -10.46 -1.72 0
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222592 85305580 1 NOSiC23H41 ABCD23E41 -94.51 1.77 -8.68 1.19 0
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222593 85305582 1 PN2O9C13H17 AB2C9D13E17 -407.94 6.38 -9.09 -1.7 0
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222594 85305584 1 SO2N4H16C20 AB2C4D16E20 38.98 5.87 -8.3 -1.2 0
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222595 85305589 1 SN2O4C19H24 AB2C4D19E24 -132.09 5.72 -8.77 -0.39 0
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222596 85305590 1 O5C22H32 A5B22C32 -211.24 3.71 -9.35 0.95 0
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222598 85305592 1 SiO4C21H32 AB4C21D32 -160.14 1.55 -8.73 -0.57 0
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222599 85305597 1 NS2O5C16H27 AB2C5D16E27 -258.63 2.89 -8.62 -0.14 0
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222600 85305598 1 NSiO4C20H31 ABC4D20E31 -189.28 7.82 -9.73 0.51 0
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222601 85305599 1 N2O7C18H22 A2B7C18D22 -107.03 8.03 -9.37 -1.88 0
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222602 85305601 1 O5H22C23 A5B22C23 -130.63 4.06 -9.99 -0.7 0
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222603 85305602 2 O2C12H13 A2B12C13 -110.46 2.35 -9.53 -0.81 0
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222604 85305603 1 S2Se3C6H7 A2B3C6D7 75.91 4.39 0.0 0.0 0
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222605 85305606 1 NO5H21C22 AB5C21D22 -128.6 4.25 -9.76 -0.95 0
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222606 85305611 1 NO3C24H29 AB3C24D29 -92.94 0.94 -8.99 -0.13 0
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222607 85305613 1 BrNSO2C17H18 ABCD2E17F18 14.19 18.49 -6.81 -2.52 1
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222608 85305614 1 NSO2C17H18 ABC2D17E18 -14.03 4.27 0.0 0.0 0
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222609 85305615 2 O3C11H13 A3B11C13 -130.17 2.75 -7.82 -1.24 0
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222610 85305620 1 ClPSN2O6C12H14 ABCD2E6F12G14 -248.1 4.71 -10.46 -2.09 0
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222611 85305621 1 INSO3C12H16 ABCD3E12F16 -96.87 5.98 -9.95 -1.07 0
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222612 85305623 1 NO5C22H23 AB5C22D23 -172.3 5.33 -8.79 -0.79 0
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222613 85305624 1 NO5C22H23 AB5C22D23 -137.07 1.74 -9.26 -0.73 0
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222614 85305625 1 NO4C23H27 AB4C23D27 -137.46 2.66 -9.57 -0.61 0
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222616 85305627 1 N3O3C22H27 A3B3C22D27 -28.88 6.5 -9.64 -0.85 0
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222617 85305630 1 N4O7C16H22 A4B7C16D22 -284.92 3.74 -9.33 -0.69 0
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222618 85305631 1 N2F3O3C19H21 A2B3C3D19E21 -227.04 22.68 -8.97 -1.43 0
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222620 85305633 1 SN4O6C15H18 AB4C6D15E18 -182.04 5.7 -10.4 -0.87 0
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222621 85305634 1 S2N4O5C14H14 A2B4C5D14E14 -118.14 7.75 -10.03 -1.24 0
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222622 85305635 1 O5C23H26 A5B23C26 -185.7 2.64 -9.63 -0.12 0
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222623 85305637 2 NO2C11H13 AB2C11D13 -132.82 7.42 -9.64 -0.15 0
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222624 85305638 1 N4O5C18H30 A4B5C18D30 -243.89 4.42 -9.51 -0.48 0
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222625 85305641 2 ON2C11H15 AB2C11D15 -45.39 5.14 -8.86 -0.24 0
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222626 85305642 1 SiO6C19H30 AB6C19D30 -310.49 2.2 -9.11 -0.05 1
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222627 85305645 1 FeNO5H17C18 ABC5D17E18 -64.19 7.07 -9.01 0.04 0
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222628 85305651 1 NSO8C15H29 ABC8D15E29 -372.04 7.91 -10.05 0.81 0