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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
311469 126592935 1 NOSC8H13 ABCD8E13 -20.15 2.98 -9.28 -0.24 0
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311470 126592936 1 ClON3C13H14 ABC3D13E14 46.36 3.39 -8.89 -0.71 0
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311471 126592937 1 ClFN4O4C29H36 ABC4D4E29F36 -168.11 3.48 -9.05 -0.7 0
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311472 126592938 1 NC10H19 AB10C19 -2.03 2.79 -9.7 1.0 0
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311473 126592939 1 NC13H23 AB13C23 3.5 2.32 -9.69 0.28 0
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311474 126592940 1 ClON3C14H22 ABC3D14E22 -50.64 2.09 -8.18 -0.21 0
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311475 126592941 1 NC10H17 AB10C17 23.75 3.3 -9.78 0.07 0
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311476 126592942 1 ON3C5H9 AB3C5D9 18.02 2.07 -9.88 0.7 0
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311477 126592943 1 OS2N4C10H16 AB2C4D10E16 1.38 5.46 -8.97 -1.12 0
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311478 126592944 1 ClON3C16H20 ABC3D16E20 47.21 1.5 -8.95 -0.66 0
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311479 126592945 1 ClON3C13H20 ABC3D13E20 -18.98 5.32 -8.95 -0.12 0
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311480 126592946 1 O3N4C14H28 A3B4C14D28 -135.11 4.23 -9.14 0.98 0
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311481 126592947 1 BrFIO2N6H23C24 ABCD2E6F23G24 -1.61 1.04 -8.41 -2.29 0
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311482 126592948 1 BrFO2N5C19H19 ABC2D5E19F19 -45.81 4.86 -9.08 -0.85 0
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311483 126592949 1 BrFO2N4C22H24 ABC2D4E22F24 -64.67 6.28 -9.23 -0.91 -1
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311484 126592951 1 BrFSN3O3C13H14 ABCD3E3F13G14 -93.44 3.78 0.0 0.0 0
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311485 126592953 1 BrFSO2N4C13H16 ABCD2E4F13G16 -31.14 4.54 -8.67 -1.01 0
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311486 126592955 1 BrFIO2N4C21H21 ABCD2E4F21G21 -39.7 5.43 -9.26 -2.18 0
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311487 126592956 1 BrFO3N5C23H23 ABC3D5E23F23 -65.98 2.74 -9.22 -0.9 0
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311488 126592957 1 BrFSN4O6C18H24 ABCD4E6F18G24 -236.64 5.54 -9.58 -0.91 0
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311489 126592958 1 BrFIO3N5C24H26 ABCD3E5F24G26 -80.31 5.34 -7.95 -2.23 0
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311490 126592959 1 SN3O4C11H17 AB3C4D11E17 -165.0 7.26 -8.35 -0.72 0
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311491 126592960 1 BrFIN2O3H13C14 ABCD2E3F13G14 -100.98 5.85 -9.26 -2.2 0
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311492 126592961 1 BrFO3N6H18C20 ABC3D6E18F20 -19.98 8.76 -9.7 -1.33 0
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311493 126592962 1 BrFO2N6H18C20 ABC2D6E18F20 -11.16 10.27 -9.47 -1.16 0
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311494 126592963 1 BrFIO2N6H17C20 ABCD2E6F17G20 2.82 11.68 -9.49 -2.41 0
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311495 126592964 1 O2N3H11C12 A2B3C11D12 78.2 7.71 -9.49 -1.36 0
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311496 126592965 1 BrFO2N6C26H26 ABC2D6E26F26 3.64 3.52 -8.36 -0.8 0
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311497 126592966 3 NC4H5 AB4C5 70.39 2.48 -8.26 0.37 0
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311498 126592967 1 BrF2O2N4H19C20 AB2C2D4E19F20 -99.77 6.06 -8.87 -0.97 0
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311499 126592968 1 BrO2F3N3H17C19 AB2C3D3E17F19 -113.47 4.0 -8.74 -1.2 0
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311500 126592969 1 N3H7C8 A3B7C8 79.21 3.21 -8.91 -1.03 0
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311501 126592970 1 BrF2O3N4H19C20 AB2C3D4E19F20 -111.89 5.06 -8.97 -1.13 0
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311502 126592971 1 BrFO2N6H22C23 ABC2D6E22F23 -6.73 3.54 -8.57 -0.82 0
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311503 126592972 1 BrFO3N6H22C23 ABC3D6E22F23 -13.79 3.18 -8.6 -1.18 0
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311504 126592973 1 N3C12H13 A3B12C13 82.47 3.43 -8.11 0.18 0
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311505 126592974 1 O2N3C9H9 A2B3C9D9 51.55 8.0 -9.4 -1.36 0
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311506 126592976 1 ON3C9H11 AB3C9D11 23.68 5.57 -8.53 -1.56 0
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311507 126592979 1 BrFO3N6C25H26 ABC3D6E25F26 -63.51 3.16 -8.45 -0.77 0
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311508 126592980 1 BrFO4N6C30H34 ABC4D6E30F34 -110.67 1.58 -8.52 -0.86 0
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311509 126592982 1 BrFIO3N6C25H25 ABCD3E6F25G25 -47.19 5.98 -8.33 -2.26 0
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311510 126592983 2 N2O2C7H10 A2B2C7D10 -76.53 10.8 -9.28 -1.03 0
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311511 126592984 2 SC4H6 AB4C6 36.17 2.25 -8.58 -0.89 0
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311512 126592985 1 N4O6C19H28 A4B6C19D28 -182.17 4.93 -9.74 -1.6 0
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311513 126592986 1 N4O4C19H30 A4B4C19D30 -175.4 6.06 -8.56 -0.28 0
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311514 126592987 1 NO3C13H23 AB3C13D23 -166.49 2.47 -9.6 0.19 0
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311515 126592988 1 BrFSO3N4C15H20 ABCD3E4F15G20 -124.93 6.75 -9.07 -0.58 0
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311516 126592989 1 BrFSN4O5C20H28 ABCD4E5F20G28 -243.77 7.6 -9.06 -0.64 0
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311517 126592990 1 N2O3C14H22 A2B3C14D22 -132.16 3.03 -9.69 -0.74 0
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311518 126592991 1 BrFO6N7C33H43 ABC6D7E33F43 -254.63 8.28 -8.66 -0.88 0
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311519 126592993 1 BrFSN4O4C13H16 ABCD4E4F13G16 -116.47 4.81 -9.37 -0.87 0
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311520 126592997 1 BrFSO3N4C15H18 ABCD3E4F15G18 -112.24 3.48 -9.29 -0.69 0
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311521 126593074 1 BrFO4N7C32H37 ABC4D7E32F37 -113.32 5.68 -8.49 -0.7 0
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311522 126593087 1 BrFSO2N5C18H19 ABCD2E5F18G19 -46.42 4.98 -9.0 -0.87 0
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311523 126593471 4 NC4H7 AB4C7 44.94 3.75 -8.06 0.43 0
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311524 126593536 1 BrFO2N5C19H19 ABC2D5E19F19 -46.79 2.89 -9.35 -0.68 0
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311525 126593560 1 ON3H9C11 AB3C9D11 45.89 4.59 -8.74 -0.55 0
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311526 126593575 3 ON2C5H10 AB2C5D10 -62.88 2.04 -9.41 -0.88 0
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311527 126593576 1 ON2C5H12 AB2C5D12 -66.19 4.43 -9.63 1.11 0
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311528 126593577 1 O2N3C5H11 A2B3C5D11 -99.91 3.7 -9.67 0.59 0
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311529 126593578 1 BrFN4O4C19H24 ABC4D4E19F24 -145.5 0.46 -9.5 -1.08 0
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311530 126593579 1 BrFO3N5C19H19 ABC3D5E19F19 -48.02 4.46 -9.41 -1.14 0
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311531 126593580 1 BrFSO2N4C13H16 ABCD2E4F13G16 -18.18 3.17 -8.74 -1.11 0
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311532 126593581 1 BrFSO3N4C14H18 ABCD3E4F14G18 -67.79 5.75 -8.17 -1.05 0
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311533 126593590 1 BrF2O4N6C21H23 AB2C4D6E21F23 -166.82 8.04 -8.94 -0.84 0
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311534 126593607 1 BrFSN4O5C22H24 ABCD4E5F22G24 -148.91 6.79 -9.56 -1.06 0
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311535 126593608 1 BrFSN4O4H16C17 ABCD4E4F16G17 -94.18 7.24 -9.34 -1.39 0
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311536 126593610 1 BrFN4O4C22H24 ABC4D4E22F24 -109.71 5.53 -9.09 -1.13 0
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311537 126593611 1 BrFISO3N4H15C17 ABCDE3F4G15H17 -71.24 10.28 -9.19 -2.42 0
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311538 126593625 1 N2C19H40 A2B19C40 -66.86 2.5 -8.46 2.93 0
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311539 126593627 1 NSC9H19 ABC9D19 -31.3 2.76 -8.94 0.48 0
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311540 126593633 1 N11O13C62H113 A11B13C62D113 -718.08 5.92 -9.37 0.12 0
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311541 126593634 1 N9O10C47H87 A9B10C47D87 -559.63 3.56 -9.22 0.27 0
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311542 126593636 2 O2C9H12 A2B9C12 -186.74 4.12 -8.88 0.04 0
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311543 126593638 1 N11O11C48H85 A11B11C48D85 -555.47 6.45 -9.46 -0.3 0