BRN7T3 -OEChem-04022110162D 51 53 0 0 0 0 0 0 0999 V2000 9.3623 7.3087 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1887 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0112 4.0727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.1887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.6887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 1.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 2.3501 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 1.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 2.3501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0902 1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4179 3.1591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8334 1.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 4.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1922 5.7952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5935 4.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7844 1.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 6.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1813 5.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7745 6.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 0.5426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5788 0.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8486 2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9319 3.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7044 2.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.7964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5756 5.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8457 4.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9133 0.8437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2452 1.8650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5278 7.1706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7979 5.5214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.8787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.8787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.8787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -6.4987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -7.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 14 1 0 0 0 0 2 17 1 0 0 0 0 3 13 1 0 0 0 0 3 16 1 0 0 0 0 4 20 2 0 0 0 0 5 29 1 0 0 0 0 5 51 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 45 1 0 0 0 0 10 28 2 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 21 2 0 0 0 0 15 36 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 22 1 0 0 0 0 18 39 1 0 0 0 0 19 23 2 0 0 0 0 19 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 24 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 26 46 1 0 0 0 0 27 30 2 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 M END $$$$