D00540 -OEChem-05072121573D 31 33 0 1 0 0 0 0 0999 V2000 -1.5507 -0.0500 2.1528 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.3869 -0.0163 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2752 -2.0895 -0.2154 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 -0.2728 -0.1446 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1014 0.2578 -0.1311 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5166 -0.1781 0.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 2.1398 0.0582 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4922 0.6243 -0.1682 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1691 0.0919 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6381 0.4734 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1518 0.0807 1.0866 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9293 1.1713 -0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3481 -1.0456 -0.1606 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1589 0.3792 -0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8074 -0.9613 -0.1161 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3261 -0.0423 -0.1595 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4759 0.7869 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 -1.9647 -0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4529 -0.2127 -0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0956 -1.5752 -0.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5802 1.7173 -0.1315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 -0.9993 -1.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6897 0.5033 -2.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1402 0.0507 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7596 1.5620 -1.4301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9793 -0.5141 1.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4798 -3.0120 -0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 0.0492 0.0303 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -2.3318 -0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 2.3984 0.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1351 2.8608 0.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 16 2 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 17 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 16 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M END $$$$