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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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38453 8087566 1 ON3C26H29 AB3C26D29 25.06 4.38 -7.96 -0.34 0
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38454 8090629 1 SN2O3H20C22 AB2C3D20E22 -49.81 5.27 -8.82 -0.81 0
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38455 8091468 1 N2O3C24H28 A2B3C24D28 -102.19 4.01 -9.5 -0.5 1
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38456 8092067 1 SO2F3N3C17H23 AB2C3D3E17F23 -211.78 11.67 0.0 0.0 1
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38457 8092290 1 SO2N3C22H32 AB2C3D22E32 -38.38 1.8 0.0 0.0 0
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38458 8092603 1 FO2N3C24H28 AB2C3D24E28 -82.32 4.3 -8.5 -0.02 0
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38459 8094604 1 ClN2O3C21H21 AB2C3D21E21 -91.61 2.79 -9.56 -0.59 0
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38460 8097211 1 BrN2O2H15C18 AB2C2D15E18 -11.76 3.18 -9.66 -1.28 0
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38461 8097540 1 F2N2O5H14C20 A2B2C5D14E20 -213.24 8.79 -9.17 -1.31 1
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38462 8099794 1 N3O4C19H22 A3B4C19D22 -10.35 6.48 0.0 0.0 0
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38463 8106451 1 ClO2F3N3C19H19 AB2C3D3E19F19 -192.19 8.56 -9.18 -0.61 0
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38464 8106625 1 ClON3C23H28 ABC3D23E28 4.0 3.44 -8.99 -0.1 0
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38465 8106772 1 ClN3O3C22H26 AB3C3D22E26 -73.05 1.85 -8.79 -0.16 0
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38466 8106991 2 ON2C12H14 AB2C12D14 5.71 4.93 -8.54 -0.32 1
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38467 8107040 1 FO3N4C23H26 AB3C4D23E26 -53.89 2.72 0.0 0.0 1
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38468 8111113 1 OSF3N3C19H19 ABC3D3E19F19 -106.74 6.64 0.0 0.0 0
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38469 8111118 1 OSF3N3C20H20 ABC3D3E20F20 -138.15 1.74 -9.08 -0.81 0
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38470 8114548 1 SN2O4C19H20 AB2C4D19E20 -135.94 6.7 -8.35 -0.71 0
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38471 8114566 1 NSO4H23C24 ABC4D23E24 -91.21 4.19 -8.46 -0.69 0
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38472 8116230 2 NO2H9C10 AB2C9D10 -78.92 2.64 -9.34 -0.92 0
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38473 8117990 1 ClFN2O3H16C18 ABC2D3E16F18 -129.29 3.48 -8.81 -0.6 1
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38474 8120155 1 O2N3C26H26 A2B3C26D26 43.7 6.12 0.0 0.0 0
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38475 8122382 1 SN3O3C14H15 AB3C3D14E15 -69.07 1.98 -8.98 -0.66 0
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38476 8122621 1 ClFSO2N3H13C18 ABCD2E3F13G18 -52.41 2.44 -9.12 -1.06 0
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38477 8127080 1 N3O4C24H25 A3B4C24D25 -64.81 5.86 -8.42 -0.95 1
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38478 8127523 1 OS2N5C19H20 AB2C5D19E20 57.56 17.03 0.0 0.0 0
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38479 8127739 1 O3N4C22H24 A3B4C22D24 -46.28 4.58 -8.64 -0.98 0
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38480 8129931 2 NOC9H11 ABC9D11 -27.69 3.48 -8.0 0.22 0
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38481 8133084 1 FN2O2H15C17 AB2C2D15E17 -46.9 5.37 -9.14 -1.41 0
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38482 8135210 1 FN2O4C17H19 AB2C4D17E19 -161.78 3.05 -9.6 -1.32 0
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38483 8135951 1 BrClNO2C11H13 ABCD2E11F13 -78.87 1.67 -9.26 -0.63 0
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38484 8136883 1 N2O3C15H20 A2B3C15D20 -101.34 2.8 -8.72 0.17 0
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38485 8136886 1 N2O3C15H20 A2B3C15D20 -95.59 3.57 -8.73 0.39 0
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38486 8136887 1 ClN3O3C18H24 AB3C3D18E24 -120.79 6.66 -9.63 -1.08 0
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38487 8136888 1 SN3O5H19C20 AB3C5D19E20 -64.82 4.82 -9.24 -1.49 0
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38488 8136889 1 ClN3O3C18H24 AB3C3D18E24 -119.92 5.98 -9.65 -1.02 0
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38489 8136890 1 N3O4C19H21 A3B4C19D21 -98.49 3.55 -9.62 -0.6 0
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38490 8136892 1 N2O3C15H20 A2B3C15D20 -98.19 2.07 -8.82 0.24 0
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38491 8136899 1 ClN3O5H12C17 AB3C5D12E17 -20.06 4.39 -9.75 -1.63 0
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38492 8136900 1 SN3O4C19H19 AB3C4D19E19 -29.46 6.07 -9.26 -1.7 0
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38493 8136902 2 NOC8H11 ABC8D11 -66.97 3.5 -9.5 -0.05 0
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38494 8136904 2 NOC8H11 ABC8D11 -65.33 2.3 -9.49 0.18 0
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38495 8136906 1 N2O5C13H16 A2B5C13D16 -130.26 7.27 -9.69 -1.76 0
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38496 8136907 1 BrN2O4C16H21 AB2C4D16E21 -129.64 6.11 -9.0 -0.81 0
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38497 8136912 1 NS2O3C20H21 AB2C3D20E21 -80.1 3.88 -8.63 -0.31 0
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38498 8136919 1 N2O3C18H26 A2B3C18D26 -114.03 5.99 -9.35 -0.49 0
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38499 8136920 1 N2O3C14H14 A2B3C14D14 -57.99 4.4 -9.6 -1.13 0
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38500 8136921 1 NCl3O4C13H14 AB3C4D13E14 -173.25 4.64 -9.28 -0.88 0
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38501 8136923 1 N2O3C18H24 A2B3C18D24 -107.88 3.77 -9.69 -0.49 0
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38502 8136924 1 N2O3C17H22 A2B3C17D22 -109.02 4.46 -9.47 -0.5 0
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38503 8136930 1 SN3O4C18H25 AB3C4D18E25 -138.69 5.71 -8.72 -0.59 0
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38504 8136931 1 SN3O4C18H25 AB3C4D18E25 -139.4 7.07 -8.77 -0.6 0
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38505 8136932 1 N4O4C19H20 A4B4C19D20 -30.54 4.85 -9.24 -1.18 0
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38506 8136936 1 ClSN3O4C18H18 ABC3D4E18F18 -101.6 7.0 -8.88 -1.28 0
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38507 8136937 1 SN3O5C19H21 AB3C5D19E21 -112.07 6.64 -9.48 -1.05 0
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38508 8136945 1 ClSN3O4H16C18 ABC3D4E16F18 -31.43 4.27 -9.58 -1.82 0
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38509 8136946 1 ClNSO4C18H18 ABCD4E18F18 -130.98 4.1 -8.74 -0.38 0
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38510 8136948 1 NSCl2O4H17C18 ABC2D4E17F18 -134.39 4.18 -9.14 -0.91 0
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38511 8136949 1 N3O4C19H27 A3B4C19D27 -155.79 1.91 -9.57 -0.03 0
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38512 8136950 1 SN3O6C16H21 AB3C6D16E21 -198.79 7.96 -9.27 -0.67 0
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38513 8136954 2 NO3C11H12 AB3C11D12 -194.19 5.08 -9.38 -0.4 0
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38514 8136955 1 ClSN3O4H16C18 ABC3D4E16F18 -28.39 4.67 -9.34 -1.93 0
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38515 8136956 1 SN2O2C14H18 AB2C2D14E18 -54.26 4.89 -9.02 -0.61 0
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38516 8136960 1 N3O4C17H19 A3B4C17D19 -72.25 3.91 -9.05 -1.16 0
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38517 8136962 1 N3O6C18H23 A3B6C18D23 -208.76 3.65 -9.29 -0.28 0
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38518 8136964 1 FN3O5H18C20 AB3C5D18E20 -154.3 4.77 -9.18 -1.33 0
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38519 8136972 1 N2O5C21H22 A2B5C21D22 -139.16 6.96 -9.55 -0.6 0
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38520 8136974 1 N3O3C13H19 A3B3C13D19 -79.8 0.67 -9.66 0.07 0
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38521 8136976 1 ClNO6C20H20 ABC6D20E20 -203.42 2.1 -9.0 -0.44 0
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38522 8136980 1 N3O3C16H19 A3B3C16D19 -92.06 4.25 -8.94 -0.33 0
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38523 8136984 1 ClN3O5H16C19 AB3C5D16E19 -92.09 5.61 -9.4 -1.18 0
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38524 8136986 1 N2O5C23H26 A2B5C23D26 -165.62 4.73 -9.21 -0.34 0
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38525 8136987 1 N3O4C18H25 A3B4C18D25 -145.07 4.74 -9.42 -0.56 0
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38526 8136990 1 N2O5C23H26 A2B5C23D26 -166.28 3.05 -9.23 -0.28 0
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38527 8136999 2 ClNOC7H7 ABCD7E7 -47.07 2.82 -9.7 -1.34 0
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38528 8137000 1 N2O3C17H24 A2B3C17D24 -111.6 5.2 -9.01 0.06 0
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38529 8137001 1 N2O5C20H22 A2B5C20D22 -155.01 5.51 -9.22 -0.3 0
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38530 8137004 1 O2S2N3C17H19 A2B2C3D17E19 -17.32 4.93 -8.46 -0.84 0
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38531 8137008 2 FNOC6H6 ABCD6E6 -137.41 4.14 -10.17 -0.85 0
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38532 8137010 2 NOC8H10 ABC8D10 -65.93 5.5 -9.48 -0.53 0
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38533 8137011 2 NO2C8H11 AB2C8D11 -131.68 2.4 -8.28 0.22 0
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38534 8137012 1 N3O3C21H23 A3B3C21D23 -66.69 3.2 -9.74 -0.34 0
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38535 8137017 1 FSN3O4H16C18 ABC3D4E16F18 -65.0 6.25 -9.26 -1.62 0
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38536 8137018 4 NOC4H5 ABC4D5 -59.39 7.3 -9.28 -1.2 0
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38537 8137019 1 N3O3C19H27 A3B3C19D27 -122.51 7.95 -9.47 -0.59 0
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38538 8137020 1 N3O3C19H27 A3B3C19D27 -123.74 6.63 -9.41 -0.5 0
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38539 8137021 1 ClO2N4C17H19 AB2C4D17E19 -19.08 4.86 -9.48 -0.49 0
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38540 8137022 1 BrF2N2O3C15H15 AB2C2D3E15F15 -173.57 2.38 -9.55 -1.08 0
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38541 8137023 1 N2O3C17H20 A2B3C17D20 -81.13 2.86 -8.95 -0.28 0
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38542 8137025 2 NO4C9H9 AB4C9D9 -245.84 3.24 -9.23 -1.48 0
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38543 8137026 1 BrClN2O3C13H14 ABC2D3E13F14 -94.88 3.19 -9.27 -0.9 0
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38544 8137027 1 BrFN2O3C13H14 ABC2D3E13F14 -124.42 3.51 -9.37 -0.7 0
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38545 8137028 2 NO2C9H9 AB2C9D9 -75.09 6.69 -9.55 -1.11 0
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38546 8137029 1 ClN3O3C15H18 AB3C3D15E18 -104.13 8.8 -9.46 -1.07 0
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38547 8137032 2 NO2C9H13 AB2C9D13 -146.76 6.13 -8.78 -0.48 0
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38548 8137036 1 N3O3C16H17 A3B3C16D17 -31.01 4.67 -9.53 -0.36 0
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38549 8137039 1 BrN2O4C15H19 AB2C4D15E19 -123.89 5.21 -8.99 -0.71 0
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38550 8137041 1 N3O5H21C22 A3B5C21D22 -131.76 6.41 -9.39 -1.5 0
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38551 8137044 1 FN3O4H12C16 AB3C4D12E16 -70.91 4.6 -9.73 -1.34 0
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38552 8137045 1 N2O4C17H24 A2B4C17D24 -141.56 6.19 -8.74 -0.41 0