BJVU97 -OEChem-04022115483D 40 43 0 0 0 0 0 0 0999 V2000 -0.4294 4.9124 -0.1789 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7115 -2.8481 0.1814 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 1.3960 1.0177 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3708 0.6672 0.2094 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7785 0.1001 0.7719 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8109 -0.5961 0.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4831 0.8580 -0.2904 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 2.3541 0.3226 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0752 2.8630 -0.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.0997 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8234 -0.9949 1.3873 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3665 1.5412 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9532 -1.3316 0.4504 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0981 -0.4273 -0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1267 0.3083 1.0444 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0445 -1.5560 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7071 -2.0867 -0.6963 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -0.8886 0.7296 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8369 3.2052 -0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3796 -1.4544 -0.3912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7539 -2.3988 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2927 -1.2006 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0467 -1.9558 -1.2847 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9005 -2.7687 -0.3228 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8465 -3.5796 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 4.7822 -1.4791 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 -0.8993 2.4128 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1192 -1.8350 1.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4143 -0.8483 0.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7036 -2.4357 -0.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4504 -0.2982 1.6188 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9226 -0.5533 -0.6407 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5623 -2.9863 -2.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2993 -0.8553 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8617 -2.1985 -1.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9168 -3.0854 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7451 -4.6410 0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6877 4.2313 -1.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3975 4.2766 -2.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 5.7847 -1.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 26 1 0 0 0 0 2 16 1 0 0 0 0 2 25 1 0 0 0 0 3 15 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 5 29 1 0 0 0 0 6 14 2 0 0 0 0 7 12 2 0 0 0 0 7 14 1 0 0 0 0 8 10 2 0 0 0 0 8 19 1 0 0 0 0 9 12 1 0 0 0 0 9 19 2 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 16 20 2 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 22 2 0 0 0 0 18 31 1 0 0 0 0 20 24 1 0 0 0 0 20 32 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$