B3MJU1 -OEChem-04022103023D 38 41 0 0 0 0 0 0 0999 V2000 -4.7238 -2.8244 -1.7742 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1493 0.9766 0.5174 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7887 -1.1245 0.5981 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4983 -0.6983 0.6959 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 1.0747 -0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1582 1.5144 -0.0063 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 -0.2549 0.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7941 0.5859 0.3996 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0633 -0.8506 0.1503 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4873 1.9734 -0.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1571 2.8489 -0.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1638 3.2969 -0.8145 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 3.7337 -0.7149 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3563 0.2743 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8875 -0.8285 1.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5087 -1.4471 -1.0292 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4342 -0.8021 -0.5261 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4859 0.6478 1.0954 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1576 -1.4027 1.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7786 -2.0215 -1.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -1.9993 0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6325 -1.4996 -0.6795 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -0.0496 0.9421 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7573 -1.1234 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5278 1.6728 -0.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 3.2305 -0.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2634 1.8692 0.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9413 3.9873 -1.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5945 4.7638 -0.9525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5551 -0.3676 2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8782 -1.4728 -1.9149 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -1.0956 -1.1134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4433 1.4819 1.7914 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7995 -1.3854 2.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1258 -2.4861 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5918 -2.4465 -0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5598 0.2431 1.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6976 -1.6577 -0.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 2 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 8 1 0 0 0 0 6 11 2 0 0 0 0 7 9 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 22 1 0 0 0 0 17 32 1 0 0 0 0 18 23 2 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$