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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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33537 7886874 1 FON2S2H15C18 ABC2D2E15F18 -6.9 3.27 -8.65 -0.98 0
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33538 7886898 1 FN3O3C23H24 AB3C3D23E24 -104.79 7.39 -8.92 -0.34 0
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33539 7886902 1 NO6C20H21 AB6C20D21 -204.14 3.47 -9.32 -0.63 0
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33540 7886911 1 SN2O4C17H20 AB2C4D17E20 -107.61 2.66 -8.75 -0.81 0
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33541 7886918 1 NSO2C23H23 ABC2D23E23 -32.35 3.46 -8.58 -0.66 0
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33542 7886923 1 SN2O5C20H20 AB2C5D20E20 -108.42 4.59 -9.08 -1.09 0
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33543 7886926 1 OS2N3C20H21 AB2C3D20E21 27.22 4.21 -8.66 -1.01 0
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33544 7886927 1 N2O2S2C13H14 A2B2C2D13E14 -37.93 1.49 -8.78 -1.1 0
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33545 7886928 1 NO6C23H27 AB6C23D27 -187.04 8.81 -8.96 -0.7 0
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33546 7886931 1 OS2N3C18H23 AB2C3D18E23 -10.65 2.49 -8.59 -0.95 0
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33547 7886933 1 FN2O4H21C24 AB2C4D21E24 -140.73 5.83 -9.12 -0.8 0
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33550 7886947 1 NO8H17C21 AB8C17D21 -148.87 5.99 -8.84 -1.83 0
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33551 7886948 1 ClO7C20H21 AB7C20D21 -229.52 4.54 -8.52 -0.79 0
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33552 7886951 1 SN3O3C15H19 AB3C3D15E19 -50.94 4.4 -8.46 -0.75 0
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33553 7886956 1 FOS2N3H18C19 ABC2D3E18F19 -11.98 3.58 -8.59 -0.93 0
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33554 7886960 1 ClOS2N3H18C19 ABC2D3E18F19 26.8 4.25 -8.73 -1.06 0
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33555 7886961 1 ClN2O2H17C21 AB2C2D17E21 -29.44 3.93 -9.14 -0.74 0
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33556 7886964 1 FN4O4C17H17 AB4C4D17E17 -155.0 3.23 -9.16 -0.99 0
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33557 7886968 1 N4O4C19H22 A4B4C19D22 -126.4 4.19 -8.75 -1.17 0
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33558 7886971 1 N4O5C19H22 A4B5C19D22 -155.87 3.31 -8.53 -0.83 0
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33559 7886973 1 N4O5C16H18 A4B5C16D18 -143.65 3.31 -9.47 -1.13 0
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33560 7886976 1 ClFOS2N3H13C17 ABCD2E3F13G17 -15.46 3.38 -8.98 -1.29 0
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33561 7886980 1 OS2N3C21H23 AB2C3D21E23 14.1 2.98 -8.67 -1.25 0
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33562 7886983 1 F2N4O4H16C17 A2B4C4D16E17 -197.19 4.96 -10.35 -1.02 0
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33563 7886993 4 NOC5H6 ABC5D6 -135.33 3.8 -8.77 -1.12 0
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33564 7887006 2 OSN2C8H10 ABC2D8E10 -54.61 2.05 -8.9 -1.22 0
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33565 7887012 1 FN4O4C17H17 AB4C4D17E17 -156.18 4.03 -9.38 -1.01 0
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33566 7887016 1 FN4O4C18H19 AB4C4D18E19 -164.5 3.53 -9.02 -0.99 0
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33567 7887017 1 O2S2N4C19H24 A2B2C4D19E24 -59.04 5.98 -8.62 -0.96 0
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33568 7887019 1 N3O6C19H21 A3B6C19D21 -175.92 5.04 -8.88 -0.79 0
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33569 7887024 2 N2O3C10H11 A2B3C10D11 -199.37 5.24 -9.32 -0.96 -1
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33570 7887027 1 N3O4H14C15 A3B4C14D15 13.44 4.18 0.0 0.0 0
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33571 7887028 1 N5O5C19H21 A5B5C19D21 -155.22 4.29 -9.89 -0.8 0
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33572 7887032 1 N3O6C19H21 A3B6C19D21 -178.84 6.26 -8.77 -0.85 0
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33573 7887039 1 OS2F3N3C18H20 AB2C3D3E18F20 -135.71 6.77 -9.05 -1.4 0
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33574 7887042 1 N5O5C20H23 A5B5C20D23 -167.39 4.22 -9.14 -1.0 0
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33575 7887044 1 ClN4O4C19H21 AB4C4D19E21 -127.6 4.2 -9.33 -0.8 0
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33576 7887045 1 ClOS2N3H18C19 ABC2D3E18F19 27.83 4.7 -8.94 -1.37 0
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33577 7887055 1 SN2O5H20C21 AB2C5D20E21 -130.43 2.78 -8.91 -1.32 0
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33578 7887061 1 ClFN2O3H16C17 ABC2D3E16F17 -141.36 4.1 -8.92 -0.64 0
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33579 7887063 3 O2H6C7 A2B6C7 -177.07 3.41 -8.78 -0.84 0
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33580 7887073 1 N3O5C23H25 A3B5C23D25 -128.99 5.17 -8.71 -0.15 0
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33581 7887074 1 OS2N5C17H21 AB2C5D17E21 30.54 7.5 -8.76 -1.49 0
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33582 7887079 1 NO4C17H21 AB4C17D21 -108.04 2.31 -8.4 0.1 0
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33583 7887080 1 O2S2N4C19H20 A2B2C4D19E20 -37.17 2.18 -8.95 -1.23 0
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33584 7887081 1 ClFNO4H17C20 ABCD4E17F20 -163.88 7.64 -9.27 -1.15 0
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33585 7887083 1 OS2N4H16C18 AB2C4D16E18 61.77 2.38 -8.75 -0.97 0
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33586 7887086 1 BrO4H15C16 AB4C15D16 -91.12 5.86 -8.81 -0.82 0
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33587 7887090 1 SN2O5C17H18 AB2C5D17E18 -108.85 5.15 -8.68 -0.61 0
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33588 7887091 1 OS2N3C20H23 AB2C3D20E23 0.64 3.49 -8.6 -0.83 0
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33589 7887094 1 SN2O5C21H22 AB2C5D21E22 -140.24 9.55 -8.76 -0.73 0
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33590 7887098 1 NSO5C16H17 ABC5D16E17 -152.13 2.4 -8.72 -0.87 0
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33591 7887099 1 ClFOS2N3H13C16 ABCD2E3F13G16 -29.47 3.93 -9.06 -1.28 0
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33592 7887103 1 O2S2N4C19H20 A2B2C4D19E20 -28.29 3.03 -8.42 -1.34 0
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33593 7887110 1 ClN3O3H20C21 AB3C3D20E21 -55.42 2.12 -9.38 -1.2 0
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33594 7887114 1 FSN2O5C19H21 ABC2D5E19F21 -203.39 2.93 -9.7 -1.43 0
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33595 7887115 1 OS2N3C19H21 AB2C3D19E21 5.12 5.31 -8.71 -1.1 0
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33596 7887116 1 ClFN2O4H14C16 ABC2D4E14F16 -95.7 7.13 -9.8 -1.47 0
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33597 7887117 1 OS2N3C19H21 AB2C3D19E21 4.46 2.82 -8.53 -1.14 0
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33598 7887118 1 N2O5C23H26 A2B5C23D26 -162.87 2.33 -8.67 -0.71 0
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33599 7887123 1 BrNSO3H12C17 ABCD3E12F17 -56.08 6.31 -8.96 -1.58 0
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33600 7887129 1 O2S2N3H13C15 A2B2C3D13E15 60.17 7.1 -8.84 -1.12 0
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33601 7887134 1 OS2N4C12H12 AB2C4D12E12 47.73 4.7 -8.91 -1.11 0
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33602 7887135 1 NSO3C18H21 ABC3D18E21 -103.66 4.14 -8.74 -1.02 0
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33603 7887137 1 NSO3C18H21 ABC3D18E21 -103.35 3.52 -8.76 -1.04 0
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33604 7887141 1 NSO3H13C17 ABC3D13E17 -57.51 4.53 -8.87 -1.45 0
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33605 7887156 1 SN2O3H12C18 AB2C3D12E18 -24.89 4.03 -9.07 -1.49 0
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33606 7887157 1 OS2N3H17C19 AB2C3D17E19 41.12 2.24 -8.76 -1.04 0
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33607 7887171 1 ON3S3C16H17 AB3C3D16E17 22.33 6.3 -8.86 -1.04 0
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33608 7887174 1 SN2O5H18C20 AB2C5D18E20 -118.85 2.79 -8.88 -1.2 0
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33609 7887177 1 OF2S2N3H17C18 AB2C2D3E17F18 -79.25 4.61 -8.9 -1.1 0
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33610 7887184 1 OS2N4C14H16 AB2C4D14E16 25.81 5.02 -8.62 -0.85 0
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33611 7887190 1 OS2N3C21H27 AB2C3D21E27 -33.12 5.58 -8.93 -1.12 0
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33612 7887197 1 FNSO3H12C17 ABCD3E12F17 -101.72 5.32 -9.11 -1.47 0
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33613 7887202 1 NSO3C18H21 ABC3D18E21 -103.11 2.95 -8.74 -1.02 0
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33614 7887211 1 O2S2N3C19H19 A2B2C3D19E19 -20.92 6.6 -8.61 -0.86 0
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33615 7887213 1 O3S3N4C16H16 A3B3C4D16E16 -53.0 2.26 -8.78 -1.0 0
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33616 7887219 1 FSO3H11C17 ABC3D11E17 -91.62 1.26 -8.84 -1.12 0
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33617 7887225 1 FNSO3H14C18 ABCD3E14F18 -108.58 5.81 -9.1 -1.47 0
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33618 7887240 1 OS2N3C19H21 AB2C3D19E21 16.19 1.34 -8.76 -0.98 0
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33619 7887242 1 OS2N3C19H21 AB2C3D19E21 16.9 0.62 -8.78 -1.02 0
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33620 7887245 1 NSO3C15H17 ABC3D15E17 -109.22 4.37 -9.05 -1.38 0
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33621 7887248 1 OS2N3C20H21 AB2C3D20E21 11.33 1.74 -8.54 -1.04 0
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33622 7887255 1 NSO3C16H19 ABC3D16E19 -109.66 4.27 -9.05 -1.4 0
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33623 7887256 1 N2S2O3H14C18 A2B2C3D14E18 -44.59 6.88 -9.03 -1.28 0
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33624 7887259 1 NSF2O3H11C17 ABC2D3E11F17 -149.54 5.45 -9.14 -1.55 0
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33625 7887267 1 NSO3H17C19 ABC3D17E19 -69.0 7.09 -9.07 -1.4 0
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33626 7887270 1 SN2O4H14C19 AB2C4D14E19 -86.44 2.24 -8.93 -1.27 0
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33627 7887272 1 FSN2O4H13C18 ABC2D4E13F18 -116.28 1.64 -8.91 -1.23 0
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33628 7887277 1 OF2N2S2H14C17 AB2C2D2E14F17 -62.92 1.89 -8.88 -1.23 0
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33629 7887281 1 O2S2N4C13H16 A2B2C4D13E16 -54.67 3.4 -9.0 -1.2 0
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33630 7887285 1 N3O3S3C15H19 A3B3C3D15E19 -89.0 5.14 -8.97 -1.17 0
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33631 7887286 1 SN2O3H14C19 AB2C3D14E19 -39.29 5.62 -8.87 -1.19 0
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33632 7887287 1 N3O3S3C15H19 A3B3C3D15E19 -88.54 7.97 -9.1 -1.33 0
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33633 7887291 1 NOCl2C17H21 ABC2D17E21 -59.48 2.43 -9.59 -0.61 0
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33634 7887293 2 NOSC9H9 ABCD9E9 -27.14 1.65 -8.81 -1.02 0
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33635 7887294 1 NS2O6H15C18 AB2C6D15E18 -191.35 2.72 -8.81 -1.12 0
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33636 7887296 1 SN2O4C18H20 AB2C4D18E20 -148.63 3.82 -8.79 -1.08 0
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33637 7887297 1 N3O3S3C16H21 A3B3C3D16E21 -95.89 3.34 -8.76 -0.97 0
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33638 7887298 1 SN2O3H12C18 AB2C3D12E18 1.78 1.99 -8.95 -1.29 0