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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175639 75929573 1 SO3N4C23H26 AB3C4D23E26 -65.36 7.98 -8.61 -1.2 0
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175640 75929686 2 SN2O2C10H13 AB2C2D10E13 -133.49 5.99 -8.98 -1.07 0
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175641 75929687 1 FSO2N3H20C22 ABC2D3E20F22 -42.85 1.86 -9.07 -1.05 1
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175642 75929688 1 ON2C12H25 AB2C12D25 -55.96 4.3 0.0 0.0 0
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175643 75929689 1 ON2C12H24 AB2C12D24 -84.0 4.37 -8.82 1.4 0
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175644 75930251 1 SN3O3C22H29 AB3C3D22E29 -99.34 3.12 -8.6 -0.02 0
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175645 75930412 1 SCl2O2N6C18H20 AB2C2D6E18F20 -15.9 1.3 -9.0 -1.21 0
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175646 75930627 1 ClO2N4C18H21 AB2C4D18E21 -35.02 4.19 -9.02 -0.69 0
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175647 75930630 1 O2N5C25H27 A2B5C25D27 23.23 6.5 -9.04 -0.83 0
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175648 75930631 1 Cl2O2N3C23H25 A2B2C3D23E25 -39.8 2.79 -9.53 -0.59 0
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175649 75930737 1 FON3C21H24 ABC3D21E24 -28.54 5.21 -8.11 -0.31 0
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175650 75930783 1 SO2N6H22C23 AB2C6D22E23 38.77 4.6 -8.75 -0.56 0
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175651 75931011 1 N3O4C26H29 A3B4C26D29 -108.39 7.84 -8.51 -0.16 0
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175652 75931189 1 SO2N4H16C18 AB2C4D16E18 54.27 5.63 -9.26 -0.59 0
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175653 75931440 1 SF2N2O4C19H22 AB2C2D4E19F22 -225.13 6.88 -9.44 -0.76 0
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175654 75931672 1 O4N5C21H25 A4B5C21D25 -76.68 5.73 -9.06 -0.74 0
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175655 75931673 1 O3N4C24H26 A3B4C24D26 -18.42 3.29 -9.14 -0.67 0
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175656 75931674 1 O2N4C21H22 A2B4C21D22 10.29 2.73 -9.04 -0.88 0
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175657 75931675 1 F3O3N4C22H25 A3B3C4D22E25 -205.17 2.86 -8.78 -0.75 0
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175658 75931676 1 ON5C21H27 AB5C21D27 26.11 7.31 -8.53 -0.5 0
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175659 75932153 1 O2N3C19H31 A2B3C19D31 -110.83 2.36 -9.37 0.4 0
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175660 75932230 1 Cl2N3C15H19 A2B3C15D19 21.72 2.08 -8.76 -1.07 0
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175661 75932479 1 S2O3N4C22H24 A2B3C4D22E24 -93.61 3.16 -8.64 -1.05 1
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175662 75932917 1 O2N4C24H29 A2B4C24D29 -42.31 4.35 0.0 0.0 0
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175663 75933289 1 FOSN6C24H25 ABCD6E24F25 63.08 6.64 -8.37 -0.91 1
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175664 75933290 1 SO3N4H15C18 AB3C4D15E18 -2.47 1.87 0.0 0.0 0
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175665 75933291 1 NS2O5C14H21 AB2C5D14E21 -223.32 5.45 -9.34 -0.54 0
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175666 75933410 2 N2O2C13H19 A2B2C13D19 -196.88 4.06 -8.75 -0.44 0
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175667 75933511 1 O4H16C17 A4B16C17 -113.78 4.87 -9.13 -0.64 0
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175668 75933854 1 OF3N3C20H22 AB3C3D20E22 -137.11 4.1 -8.46 -1.04 1
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175669 75933863 1 FO2N3C19H31 AB2C3D19E31 -109.13 1.31 0.0 0.0 1
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175670 75933920 1 N3O4C21H32 A3B4C21D32 -145.04 4.96 0.0 0.0 0
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175671 75934082 1 NF2O4C17H23 AB2C4D17E23 -253.68 6.0 -9.08 -0.81 0
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175672 75934575 1 ClSO2N3H14C20 ABC2D3E14F20 4.61 4.42 -8.74 -0.95 0
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175673 75934727 1 SN2O6C21H30 AB2C6D21E30 -245.82 5.2 -9.33 -0.76 0
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175674 75934733 1 SN2O4C22H26 AB2C4D22E26 -109.15 6.72 -9.14 -0.64 0
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175675 75934734 1 ClN3O4C22H22 AB3C4D22E22 -71.21 3.37 -9.38 -0.97 0
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175676 75934735 1 SN3O4C24H27 AB3C4D24E27 -121.86 2.56 -8.72 -1.11 0
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175677 75934836 1 BrN3O3H12C15 AB3C3D12E15 -32.33 7.61 -9.49 -1.19 0
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175678 75934837 1 O3N5H13C14 A3B5C13D14 -21.2 9.28 -9.43 -1.59 0
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175679 75934838 1 ClN3O5C24H28 AB3C5D24E28 -175.84 6.95 -9.22 -0.63 0
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175680 75934839 1 N2O3C22H26 A2B3C22D26 -100.87 2.65 -9.26 -0.2 0
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175681 75934840 1 ClN3O4C22H24 AB3C4D22E24 -137.79 6.48 -8.99 -0.39 1
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175682 75935136 1 FON6C23H24 ABC6D23E24 44.73 3.64 0.0 0.0 1
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175683 75936258 1 SN4O5C23H27 AB4C5D23E27 -33.04 5.37 0.0 0.0 1
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175684 75936485 1 ON4C23H33 AB4C23D33 12.21 2.39 0.0 0.0 1
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175685 75936844 1 Cl2N2O2C18H23 A2B2C2D18E23 -50.32 2.48 0.0 0.0 0
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175686 75937431 1 BrN2O2F3C14H18 AB2C2D3E14F18 -232.66 6.36 -9.41 -0.18 0
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175687 75937432 1 ClN2O2F3C14H18 AB2C2D3E14F18 -241.82 1.23 -9.47 -0.15 0
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175688 75937433 1 O3N4C20H28 A3B4C20D28 -82.31 5.48 -8.72 0.13 0