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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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187556 77591242 1 O2N6C23H38 A2B6C23D38 -75.93 4.89 -8.61 0.06 0
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187557 77591430 1 F3N4O7C30H33 A3B4C7D30E33 -403.44 1.76 -8.69 -1.06 0
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187558 77591942 1 BNO3C17H22 ABC3D17E22 -169.73 5.64 -9.35 -0.41 0
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187559 77591978 1 NO5C23H29 AB5C23D29 -112.3 1.24 -8.79 -0.47 0
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187560 77592116 1 FO4N5C20H20 AB4C5D20E20 -81.89 4.43 -9.11 -0.95 0
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187561 77592383 1 N4O5C33H34 A4B5C33D34 -133.79 7.33 -8.84 -0.26 0
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187562 77592468 1 FO2N4C19H19 AB2C4D19E19 -46.29 6.56 -9.01 -0.88 0
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187563 77592742 1 N4O5H22C23 A4B5C22D23 -136.61 11.47 -8.78 -1.44 0
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187564 77592743 1 N4O5H26C29 A4B5C26D29 -114.09 8.56 -8.64 -1.44 0
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187565 77592744 1 N4O5C25H26 A4B5C25D26 -150.12 11.64 -8.74 -1.33 0
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187566 77592745 2 N2O4H11C12 A2B4C11D12 -181.71 4.79 -9.51 -2.0 0
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187567 77592746 1 N2O5C11H16 A2B5C11D16 -215.43 6.25 -10.57 -0.11 0
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187568 77593357 1 N2S2O7C29H38 A2B2C7D29E38 -274.08 6.97 -8.71 -0.24 0
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187569 77593358 1 ClN3O4C29H36 AB3C4D29E36 -180.17 3.15 -9.64 -0.36 0
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187570 77593359 1 BrNO3H10C13 ABC3D10E13 -63.16 3.84 -9.87 -1.78 0
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187571 77593360 1 NF2O3H19C20 AB2C3D19E20 -188.27 4.08 -9.95 -0.5 0
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187572 77593361 1 SCl2N2O5C28H30 AB2C2D5E28F30 -199.33 3.65 -9.84 -1.49 0
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187573 77593752 1 ClO2N3F4H24C25 AB2C3D4E24F25 -219.63 6.14 -9.18 -1.04 0
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187574 77593912 1 NO2C8H15 AB2C8D15 -84.77 3.89 -8.98 0.52 0
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187575 77593952 1 BrO2N3C16H24 AB2C3D16E24 -61.22 5.15 -8.64 0.02 0
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187576 77593953 1 N2O2F5C27H27 A2B2C5D27E27 -299.95 8.93 -9.35 -0.35 0
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187577 77593954 1 Cl2N2O4C29H36 A2B2C4D29E36 -202.46 3.46 -9.4 -0.66 0
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187578 77594026 2 NO2C6H11 AB2C6D11 -213.45 8.87 -9.96 0.67 0
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187579 77594027 1 O3N5C26H37 A3B5C26D37 -75.8 4.96 -8.7 -0.48 0
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187580 77594028 1 NO2C26H33 AB2C26D33 -71.98 2.55 -9.06 -0.29 0
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187581 77594029 1 N2O3C13H20 A2B3C13D20 -106.9 4.96 -9.9 0.36 0
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187582 77594030 2 ON2C12H15 AB2C12D15 -36.87 6.16 -7.95 -0.51 0
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187583 77594031 1 N3O3H25C29 A3B3C25D29 4.98 10.79 -8.93 -1.15 0
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187584 77594032 1 FO2N3H22C23 AB2C3D22E23 -45.86 6.54 -8.99 -1.27 0
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187585 77594033 1 N3O3C24H25 A3B3C24D25 -34.48 5.2 -8.24 -1.34 0
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187586 77594034 1 SO2N3C15H17 AB2C3D15E17 -11.63 8.01 -9.49 -1.41 0
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187587 77594392 1 F2N3O3C32H47 A2B3C3D32E47 -248.62 2.47 -8.54 -0.42 0
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187588 77594595 1 ClFO3N4C26H26 ABC3D4E26F26 -105.67 4.07 -9.22 -0.6 0
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187589 77595273 1 BN2F3O7C29H42 AB2C3D7E29F42 -575.85 3.74 -9.94 -0.7 0
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187590 77595274 1 S2N3F4O5H31C37 A2B3C4D5E31F37 -165.4 3.88 -8.23 -1.89 0
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187591 77595339 1 F2O4N9C36H43 A2B4C9D36E43 -163.33 5.97 -8.62 -0.98 0
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187592 77595340 1 O4N9C34H45 A4B9C34D45 -88.15 2.41 -7.94 -0.6 -1
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187593 77595341 1 SN2O4H13C16 AB2C4D13E16 -55.16 8.48 0.0 0.0 -1
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187594 77595342 1 SN2F3O4H14C21 AB2C3D4E14F21 -203.54 8.25 0.0 0.0 0
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187595 77595343 1 F3N4O7C15H15 A3B4C7D15E15 -395.61 4.51 -8.99 -0.64 0
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187596 77595684 1 BN2O4C17H27 AB2C4D17E27 -236.81 4.02 -9.26 0.26 0
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187597 77595685 1 SO2F3N4C24H31 AB2C3D4E24F31 -180.35 10.54 -8.83 -1.29 0
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187598 77595686 1 SO2N4C27H40 AB2C4D27E40 -47.35 6.2 -8.68 -0.47 0
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187599 77595687 1 NO2C25H25 AB2C25D25 79.51 2.22 -8.04 -1.33 0
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187600 77595688 1 PF2N5O7C22H24 AB2C5D7E22F24 -373.33 6.37 -9.34 -1.16 0
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187601 77595689 1 ON2C14H14 AB2C14D14 28.9 2.84 -9.06 -0.39 0
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187602 77595690 1 PF2N5O7C22H24 AB2C5D7E22F24 -360.17 4.18 -9.12 -1.16 0
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187603 77595691 1 F3N5H14C16 A3B5C14D16 -24.79 3.39 -9.88 -1.22 0
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187604 77595947 1 SN5O5C31H37 AB5C5D31E37 -148.14 14.49 -9.02 -0.96 0
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187605 77595948 1 ClNO4C31H38 ABC4D31E38 -175.49 10.78 -9.24 -0.7 0