B1OZR9 -OEChem-04022113223D 51 54 0 0 0 0 0 0 0999 V2000 1.9767 3.6827 -1.0884 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7033 2.4331 -1.9505 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9456 -1.5884 -0.5497 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9725 -3.6772 0.7728 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6761 -1.8220 -0.0488 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -3.3710 0.0527 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0262 1.4677 -1.0867 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4769 2.2669 0.5105 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2768 0.6720 1.7756 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4074 -1.2331 0.4021 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6742 -3.2617 -0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -2.2777 0.9932 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3263 -3.7454 -0.8313 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 -1.1125 -0.1742 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 -3.9897 0.0353 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8725 0.3198 0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2087 -5.1117 -0.9589 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0413 1.2000 -0.5276 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7014 0.7965 1.1809 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0391 2.5570 -0.2049 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 2.1535 1.5036 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 3.0337 0.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3664 2.9945 -0.7333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2138 2.8255 0.5064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8362 2.0196 -0.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1814 1.0090 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2831 0.4753 -1.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2276 1.0847 1.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3815 0.0399 -0.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3292 0.1588 1.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9372 -0.7721 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5944 -0.4551 1.1481 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9152 -3.7546 0.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4685 -3.5154 -1.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9076 -2.7266 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4776 -1.8095 1.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1152 -3.2957 -1.8089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3497 -4.8313 -0.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6143 -5.9763 -0.6525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 -4.7882 -1.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2614 -5.4087 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4211 0.8303 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3517 0.1202 1.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3437 2.5246 2.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8792 4.0879 1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2385 3.0936 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1669 1.3348 -2.0869 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2976 0.3931 -2.0962 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4189 1.4837 1.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 -0.3795 -0.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1601 -0.1664 1.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 23 1 0 0 0 0 2 23 1 0 0 0 0 2 25 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 7 47 1 0 0 0 0 8 24 1 0 0 0 0 8 25 2 0 0 0 0 9 28 1 0 0 0 0 9 30 2 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 19 43 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 24 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M END $$$$