B7A6WM -OEChem-04042104553D 47 49 0 0 0 0 0 0 0999 V2000 0.9050 -1.3471 0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9136 0.7628 0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3913 0.6047 0.0016 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5885 -1.3793 -0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 2.7819 -0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4663 -0.5074 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0124 -0.1745 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 0.0051 1.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1869 0.0065 -1.2625 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0932 0.5106 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6016 1.1585 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0633 -1.1968 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2928 0.4471 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3386 -0.8785 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6981 0.1171 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2418 1.4694 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7035 -0.8861 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7754 0.9985 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 1.3753 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2426 -1.7371 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9324 -1.2523 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6254 -0.5107 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4851 0.8623 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8241 -0.1229 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9934 -1.1072 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 -1.6002 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 -0.3692 2.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 -0.3373 1.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1972 1.0992 1.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2274 -0.3359 -1.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6981 -0.3667 -2.1693 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1955 1.1007 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3234 1.9705 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3673 -2.2403 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 2.5122 0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -1.7326 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5574 2.0625 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4011 -2.8142 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1579 -2.0061 0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3532 1.5139 -0.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6945 1.7558 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3023 1.6178 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5436 -0.7951 -0.8963 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9457 -2.2012 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5474 -0.7924 0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 3.3683 -0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1341 3.2248 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 13 1 0 0 0 0 2 24 1 0 0 0 0 2 41 1 0 0 0 0 3 15 1 0 0 0 0 3 24 1 0 0 0 0 3 42 1 0 0 0 0 4 14 2 0 0 0 0 4 22 1 0 0 0 0 5 19 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 10 19 2 0 0 0 0 11 16 1 0 0 0 0 11 33 1 0 0 0 0 12 17 2 0 0 0 0 12 34 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 20 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 40 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$