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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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379949 134964391 1 NOH11C15 ABC11D15 52.05 13.13 -7.76 -1.51 0
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379950 134964392 1 NBr2H11C15 AB2C11D15 55.49 4.27 -8.62 -0.52 0
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379951 134964393 1 FC15H19 AB15C19 -44.33 2.3 -9.06 0.02 0
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379952 134964394 1 NH11C15 AB11C15 112.07 2.93 -9.47 -0.34 0
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379953 134964395 1 ClOC12H15 ABC12D15 -35.08 3.7 -9.37 -0.07 0
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379954 134964396 1 O5C11H16 A5B11C16 -199.9 1.75 -10.39 -0.24 0
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379955 134964397 1 NOSiC16H21 ABCD16E21 -16.68 4.3 -8.25 0.15 0
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379956 134964398 1 NOC16H23 ABC16D23 7.29 3.57 -6.5 -0.3 0
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379957 134964399 1 O2C13H16 A2B13C16 -37.78 4.21 -9.43 0.28 0
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379958 134964400 1 NOF5H26C31 ABC5D26E31 -189.47 4.99 -9.28 -1.11 0
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379959 134964401 1 N2O3C14H18 A2B3C14D18 -85.74 1.44 -8.38 -0.45 0
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379960 134964402 1 NSiO5C11H21 ABC5D11E21 -265.13 5.0 -9.54 0.55 0
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379961 134964403 1 SN2O2C9H18 AB2C2D9E18 -125.65 2.0 -9.27 0.22 0
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379963 134964405 1 NO2C17H33 AB2C17D33 -158.52 6.03 -9.74 1.34 0
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379964 134964406 1 FO2H9C11 AB2C9D11 -70.6 3.61 -8.57 -0.43 0
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379965 134964407 1 FC15H19 AB15C19 -37.6 2.45 -9.32 0.09 0
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379966 134964408 1 O4C13H26 A4B13C26 -232.29 2.3 -10.62 0.76 0
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379967 134964409 1 O3C12H16 A3B12C16 -114.9 2.46 -8.83 0.17 0
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379968 134964410 1 ON2C13H16 AB2C13D16 21.31 5.38 -10.52 -0.03 0
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379969 134964411 2 O2C7H8 A2B7C8 -145.77 0.78 -9.82 -0.66 0
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379970 134964412 1 OC13H22 AB13C22 -64.74 3.38 -10.04 0.78 0
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379971 134964413 1 O2N3C13H27 A2B3C13D27 -132.43 2.65 -9.62 0.94 0
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379972 134964414 1 NO3C13H13 AB3C13D13 -95.43 2.18 -9.39 -0.5 0
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379973 134964415 1 SiO2C15H22 AB2C15D22 -93.38 1.3 -8.74 0.1 0
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379974 134964416 1 SN2O2C7H14 AB2C2D7E14 -58.11 2.17 -9.31 -1.16 0
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379975 134964417 1 NO3C14H17 AB3C14D17 -116.23 2.74 -9.72 -0.11 0
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379976 134964418 1 NSH9C15 ABC9D15 133.55 1.65 -9.0 -1.11 0
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379977 134964419 1 OC14H20 AB14C20 -59.86 3.1 -9.66 0.83 0
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379978 134964420 6 H2C3 A2B3 109.92 2.12 -8.1 -0.73 0
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379979 134964422 1 ON2H8C14 AB2C8D14 67.65 6.93 -9.12 -1.54 0
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379980 134964423 1 SO3C16H16 AB3C16D16 -63.77 5.49 -8.82 -0.35 0
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379981 134964424 1 NpSiO2C13H19 ABC2D13E19 -456.65 3.41 0.0 0.0 0
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379982 134964425 1 SiO2C13H19 AB2C13D19 -68.63 2.77 0.0 0.0 0
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379983 134964427 1 NO3C13H15 AB3C13D15 -30.15 4.32 -9.38 -0.46 0
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379984 134964428 1 NO3C12H21 AB3C12D21 -127.88 4.41 -9.24 0.78 0
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379985 134964429 2 OC5H7 AB5C7 -84.0 1.4 -9.93 0.78 0
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379986 134964430 1 OC14H14 AB14C14 25.6 3.17 -9.5 0.12 0
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379987 134964431 1 O3C16H22 A3B16C22 -133.66 3.06 -9.49 -0.21 0
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379988 134964433 1 NOC17H21 ABC17D21 -23.5 0.82 -9.05 0.06 0
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379989 134964435 1 ClNF3H11C14 ABC3D11E14 -120.33 3.81 -9.64 -1.0 0
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379990 134964436 1 O4C13H24 A4B13C24 -206.58 3.51 -9.48 0.96 0
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379991 134964437 1 NOH13C14 ABC13D14 21.29 3.99 -9.05 -0.34 0
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379992 134964438 1 NC18H27 AB18C27 -15.35 1.5 -8.47 0.52 0
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379993 134964439 1 NSO3C9H19 ABC3D9E19 -140.11 3.8 -9.61 0.4 0
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379994 134964443 1 NC15H21 AB15C21 -2.65 2.33 -8.09 0.59 0
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379995 134964445 1 FNSO2C15H22 ABCD2E15F22 -135.88 7.15 -9.25 -0.34 1
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379996 134964446 1 BrPO2C8H9 ABC2D8E9 -65.56 1.83 0.0 0.0 0
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379998 134964456 1 NPO4C8H18 ABC4D8E18 -262.07 3.82 -9.55 0.95 0
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379999 134964460 2 SSbH5C6 ABC5D6 105.3 1.76 -8.19 -0.8 1
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380000 134964463 1 NC16H22 AB16C22 37.46 2.02 0.0 0.0 0
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380001 134964464 1 NO3C16H23 AB3C16D23 -65.71 5.71 -9.75 -0.42 0
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380002 134964467 1 SiBr2S2H8C10 AB2C2D8E10 49.82 3.87 -8.57 -0.8 0
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380003 134964468 1 OC17H28 AB17C28 -47.33 2.14 -9.08 0.97 0
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380004 134964469 1 BrO4H9C10 AB4C9D10 -122.95 6.08 -9.48 -1.0 0
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380005 134964471 1 NSH13C14 ABC13D14 70.79 3.4 -9.39 -0.5 0
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380006 134964472 2 OC7H9 AB7C9 -41.52 1.41 -8.77 0.47 0
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380007 134964473 1 OC14H20 AB14C20 -53.52 2.46 -9.06 0.65 1
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380008 134964474 1 NC17H22 AB17C22 54.0 2.0 0.0 0.0 0
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380009 134964475 1 NC14H27 AB14C27 -32.91 1.6 -8.48 1.49 0
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380010 134964478 1 NC17H25 AB17C25 15.25 1.19 -8.57 0.47 0
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380011 134964479 1 O3C14H14 A3B14C14 -8.31 1.76 -9.37 -0.36 0
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380012 134964480 1 OPC18H23 ABC18D23 -34.4 1.5 -8.12 0.32 0
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380013 134964481 1 ClOSC14H19 ABCD14E19 -61.52 4.28 -8.72 -0.34 0
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380015 134964483 1 OC16H20 AB16C20 -26.05 2.84 -9.03 -0.14 0
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380016 134964484 2 O2H6C7 A2B6C7 -115.51 5.9 -9.09 -1.24 0
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380017 134964488 3 C4H5 A4B5 55.23 0.68 0.0 0.0 1
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380018 134964490 1 BrPO2C9H11 ABC2D9E11 -78.48 1.08 0.0 0.0 0
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380019 134964491 1 NO4H9C14 AB4C9D14 -12.54 4.95 -10.24 -1.54 1
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380020 134964492 1 NC16H22 AB16C22 32.41 2.59 0.0 0.0 0
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380021 134964493 1 NC16H21 AB16C21 34.14 1.05 -8.95 0.19 -1
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380022 134964494 1 NH14C18 AB14C18 99.52 1.62 0.0 0.0 0
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380023 134964497 1 NC12H15 AB12C15 30.63 1.96 -9.21 0.4 0
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380024 134964498 1 NO2F3C8H12 AB2C3D8E12 -261.2 6.28 -9.72 0.19 0
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380025 134964499 1 SO4C15H24 AB4C15D24 -198.26 2.59 -8.91 -0.38 0
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380026 134964500 1 OC11H22 AB11C22 -92.21 3.06 -9.9 0.86 0