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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36552 8008505 1 ClNO3C17H19 ABC3D17E19 -67.7 7.88 0.0 0.0 0
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36553 8008521 1 FN2O2C15H19 AB2C2D15E19 -112.56 1.85 -9.77 -0.74 1
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36554 8008552 1 SO2N3C23H26 AB2C3D23E26 -7.04 5.38 0.0 0.0 0
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36555 8008637 1 SN2O2H22C23 AB2C2D22E23 -14.83 2.32 -9.23 -0.87 0
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36556 8008682 1 O3N5C15H21 A3B5C15D21 -22.33 8.33 -10.27 -0.89 1
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36557 8008686 1 ON4C24H31 AB4C24D31 22.82 5.47 0.0 0.0 0
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36558 8008715 1 ClSO2N3C21H30 ABC2D3E21F30 -106.55 1.93 -9.02 -0.17 0
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36559 8008742 1 NSO3H21C23 ABC3D21E23 -49.88 5.63 -8.55 -0.72 1
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36560 8008798 1 ClOSN3C21H25 ABCD3E21F25 19.56 10.51 0.0 0.0 0
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36561 8008804 1 NSO4C16H17 ABC4D16E17 -123.76 8.42 -9.46 -0.74 0
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36562 8008832 1 N2O2C21H26 A2B2C21D26 -87.97 5.01 -8.54 -0.1 0
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36563 8008942 1 FON2C23H23 ABC2D23E23 -23.57 3.65 -8.72 -0.18 0
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36564 8008963 1 N2O4C17H26 A2B4C17D26 -172.8 3.71 -8.34 0.06 0
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36565 8008978 1 N3O5C19H29 A3B5C19D29 -263.48 5.9 -10.0 0.17 -1
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36566 8008979 1 N3O5C19H28 A3B5C19D28 -250.14 8.75 0.0 0.0 0
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36567 8008980 1 N3O5C19H29 A3B5C19D29 -267.33 9.11 -10.36 -0.05 1
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36568 8008981 1 BrFO2N3C18H18 ABC2D3E18F18 -4.99 7.47 0.0 0.0 0
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36569 8008983 1 SN3O3C21H25 AB3C3D21E25 -87.22 3.91 -9.21 -0.37 0
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36570 8008984 1 SN3O3C21H25 AB3C3D21E25 -88.33 3.84 -9.33 -0.31 0
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36571 8009009 1 SN3O5C20H25 AB3C5D20E25 -165.77 10.06 -9.18 -1.02 0
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36572 8009025 1 FN2O2C23H23 AB2C2D23E23 -62.12 3.6 -9.11 -0.88 1
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36573 8009036 1 SN3O4C19H30 AB3C4D19E30 -124.89 1.93 0.0 0.0 0
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36574 8009042 1 SN2O2C11H14 AB2C2D11E14 -36.14 4.14 -10.09 -1.37 1
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36575 8009044 1 N2O4C23H29 A2B4C23D29 -107.78 4.53 0.0 0.0 1
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36576 8009059 1 NO2C14H22 AB2C14D22 -63.27 3.27 0.0 0.0 1
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36577 8009065 1 ON3C16H24 AB3C16D24 20.4 6.06 0.0 0.0 1
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36578 8009070 1 NO2C14H24 AB2C14D24 -64.28 5.95 0.0 0.0 0
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36579 8009073 1 O2N6C21H22 A2B6C21D22 42.24 5.55 -8.68 -0.52 0
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36580 8009076 1 SN2O3C12H16 AB2C3D12E16 -107.56 3.56 -9.54 -1.04 0
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36581 8009147 1 SF2N3O5H11C16 AB2C3D5E11F16 -230.48 10.65 -8.86 -2.13 0
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36582 8009149 1 N2O4C21H28 A2B4C21D28 -174.62 3.26 -8.86 -0.43 0
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36583 8009170 1 N2F3O3C8H9 A2B3C3D8E9 -265.44 3.12 -10.04 -0.32 1
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36584 8009173 1 ON3C16H20 AB3C16D20 13.44 3.35 0.0 0.0 0
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36585 8009194 1 N2O2C15H18 A2B2C15D18 -66.78 1.61 -9.18 -0.28 0
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36586 8009228 1 NO4C18H19 AB4C18D19 -129.16 7.57 -8.99 -1.0 0
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36587 8009230 1 N2O3C22H22 A2B3C22D22 -49.08 6.13 -8.95 -0.79 0
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36588 8009232 1 ClNO4H16C17 ABC4D16E17 -130.97 4.77 -9.1 -1.07 0
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36589 8009247 1 ClFNO4H13C16 ABCD4E13F16 -170.09 3.93 -9.11 -1.12 0
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36590 8009271 1 F3N6H11C13 A3B6C11D13 -33.95 3.22 -9.54 -1.27 0
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36591 8009277 1 NCl2O4C19H19 AB2C4D19E19 -149.09 5.7 -9.28 -0.82 0
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36592 8009278 1 NO5C20H23 AB5C20D23 -160.47 1.76 -8.69 -0.57 0
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36593 8009340 1 NSO6C18H19 ABC6D18E19 -201.75 7.9 -8.97 -1.01 0
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36594 8009345 1 OSN2F3H11C20 ABC2D3E11F20 -65.5 5.06 -9.38 -1.08 0
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36595 8009347 2 NO2C8H9 AB2C8D9 -122.16 5.19 -9.39 -1.06 0
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36596 8009349 1 BrNO4C19H20 ABC4D19E20 -106.47 2.23 -8.99 -0.86 0
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36597 8009356 1 BrNO4C19H20 ABC4D19E20 -107.14 4.71 -9.0 -0.91 0
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36598 8009361 1 N2O5C22H26 A2B5C22D26 -157.53 5.08 -8.68 -0.86 0
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36599 8009363 1 N2O5C21H24 A2B5C21D24 -168.36 5.31 -8.64 -0.86 0
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36600 8009365 1 SO2N3C23H23 AB2C3D23E23 -10.54 5.73 -8.6 -0.41 0
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36601 8009367 1 N2O5C20H22 A2B5C20D22 -155.89 7.27 -8.59 -0.55 0
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36602 8009369 1 N2O5C24H30 A2B5C24D30 -188.06 6.89 -8.97 -0.46 0
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36603 8009390 1 N2O5C20H22 A2B5C20D22 -170.44 6.41 -8.79 -0.95 1
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36604 8009391 1 O3N4C21H25 A3B4C21D25 -60.94 1.7 0.0 0.0 0
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36605 8009528 1 N2O3C17H26 A2B3C17D26 -146.85 2.68 -9.02 0.03 0
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36606 8009542 1 N2O3C23H30 A2B3C23D30 -111.26 6.01 -9.09 -0.37 0
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36607 8009577 1 SN2O4C21H22 AB2C4D21E22 -64.99 6.09 -8.8 -0.26 0
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36608 8009613 1 SN4O4C18H26 AB4C4D18E26 -127.23 5.65 -8.75 -0.07 1
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36609 8009649 1 N3O5C23H28 A3B5C23D28 -122.91 9.53 0.0 0.0 0
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36610 8009651 2 NO2C11H12 AB2C11D12 -129.79 5.48 -9.26 -0.19 0
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36611 8009659 1 N4O4H22C23 A4B4C22D23 -70.6 7.18 -9.35 -1.41 0
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36612 8009842 1 SO3N5C16H23 AB3C5D16E23 -109.51 2.13 -9.73 -1.19 0
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36613 8009843 1 SO3N5C16H23 AB3C5D16E23 -104.73 9.3 -9.6 -0.82 1
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36614 8009846 1 ON4C22H25 AB4C22D25 35.83 3.33 0.0 0.0 0
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36615 8009889 1 N2O4C21H24 A2B4C21D24 -153.65 1.73 -9.38 -0.36 0
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36616 8009901 2 NO2H11C12 AB2C11D12 -110.91 5.69 -8.39 -0.39 0
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36617 8009908 1 O2N3C23H27 A2B3C23D27 -30.86 1.75 -9.1 -0.67 1
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36618 8009918 1 SO3N4C19H23 AB3C4D19E23 -64.63 8.78 0.0 0.0 0
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36619 8009931 1 OSN3C21H21 ABC3D21E21 30.32 2.9 -8.61 -0.55 0
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36620 8009948 1 O2F3N4C19H23 A2B3C4D19E23 -218.9 4.47 -9.03 -0.73 0
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36621 8009967 1 OSCl2N5C12H13 ABC2D5E12F13 10.17 5.87 -9.01 -0.47 0
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36622 8009989 1 OSN5C23H23 ABC5D23E23 80.75 3.57 -8.46 -0.12 0
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36623 8010013 1 OSN5C16H17 ABC5D16E17 45.72 2.98 -8.87 -0.44 0
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36624 8010015 1 ClN2O3H19C22 AB2C3D19E22 -66.33 6.13 -9.48 -1.01 0
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36625 8010020 1 OSCl2N4C17H20 ABC2D4E17F20 -19.91 2.74 -8.15 -1.03 0
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36626 8010059 1 ClOSN5H16C17 ABCD5E16F17 43.52 7.19 -8.75 -0.64 0
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36627 8010084 1 OSN5H15C16 ABC5D15E16 62.39 5.48 -8.68 -0.46 0
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36628 8010087 1 NSF2O6C15H17 ABC2D6E15F17 -332.74 5.7 -9.99 -0.95 0
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36629 8010088 1 SO2N4C16H24 AB2C4D16E24 -88.91 4.73 -9.05 -0.68 0
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36630 8010096 1 SN4C16H26 AB4C16D26 25.07 7.72 -8.39 -0.36 0
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36631 8010101 1 SN3O3H17C20 AB3C3D17E20 -34.86 5.26 -9.15 -0.77 0
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36632 8010127 1 OS2N6C16H18 AB2C6D16E18 61.23 3.62 -8.7 -0.71 0
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36633 8010130 1 FN2O4H15C19 AB2C4D15E19 -145.13 5.15 -9.22 -1.44 0
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36634 8010147 1 NSF2O6H15C16 ABC2D6E15F16 -305.13 3.01 -8.98 -1.12 0
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36635 8010169 1 SF2N2O5H14C17 AB2C2D5E14F17 -209.7 6.43 -9.32 -1.03 0
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36636 8010194 1 FOSN5C11H12 ABCD5E11F12 -18.97 5.35 -8.69 -0.4 0
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36637 8010208 1 O2S2N6C13H14 A2B2C6D13E14 17.12 5.82 -8.68 -0.73 0
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36638 8010217 1 SN2O4H16C20 AB2C4D16E20 -50.25 3.43 -8.7 -1.18 0
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36639 8010226 1 NCl3O4H14C17 AB3C4D14E17 -123.18 2.66 -9.22 -1.08 0
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36640 8010234 1 SN2O5H14C17 AB2C5D14E17 -94.88 5.48 -8.86 -1.17 0
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36641 8010244 1 ClSN3O4H16C18 ABC3D4E16F18 -88.7 4.04 -9.23 -0.88 0
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36642 8010268 1 N2S2O3H16C20 A2B2C3D16E20 -12.03 5.56 -8.91 -1.08 0
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36643 8010272 1 FSO2N6C15H19 ABC2D6E15F19 -64.35 5.68 -8.74 -0.07 0
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36644 8010274 1 SN3O5H13C17 AB3C5D13E17 -18.77 2.24 -9.73 -1.68 0
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36645 8010281 1 NCl2O4C20H21 AB2C4D20E21 -134.18 2.3 -8.92 -0.8 0
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36646 8010287 1 N2S2O5C18H18 A2B2C5D18E18 -125.44 5.82 -9.8 -1.13 0
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36647 8010289 1 N2S2O5C18H18 A2B2C5D18E18 -125.06 6.53 -9.8 -1.09 0
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36648 8010300 1 OSF2N5C12H13 ABC2D5E12F13 -65.13 4.34 -9.16 -0.47 0
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36649 8010304 1 NO4C21H25 AB4C21D25 -123.17 2.6 -8.7 -0.95 0
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36650 8010314 1 O2S2N3C15H19 A2B2C3D15E19 -26.66 4.32 -8.54 -1.15 0
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36651 8010317 1 NO6C20H21 AB6C20D21 -185.56 2.38 -9.05 -0.93 0