DR2116 -OEChem-05042003353D 36 37 0 1 0 0 0 0 0999 V2000 3.5319 1.6460 0.0472 P 0 0 2 0 0 0 0 0 0 0 0 0 0.4880 -1.2498 1.1104 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0207 -4.1029 0.1889 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2097 -3.4141 -1.2016 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7607 0.3055 0.5782 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8917 0.9602 -0.5458 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9143 2.4853 1.2470 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7611 2.2586 -1.1021 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 3.0247 -0.3488 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8299 3.7921 -0.4274 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7826 -0.7788 0.3908 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0755 -2.8704 -0.5297 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3330 -2.3813 -0.8016 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6233 -1.7869 0.3936 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7172 -1.8010 0.5475 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2977 -0.6495 -0.3605 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4378 0.4979 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -1.1512 0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4125 1.4737 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -0.2181 0.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 1.1074 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0408 2.8525 -0.2768 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6605 -3.0381 -1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3242 -1.6098 -1.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -2.1901 1.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0928 -2.5590 1.2461 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5976 -0.1541 -1.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -1.0287 -0.9399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9364 -4.3636 0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1737 -4.1163 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3798 0.7036 0.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2707 -2.1976 0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1272 -0.5169 0.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5448 1.8407 -0.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8578 0.5432 -1.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4522 3.9588 -0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 12 1 0 0 0 0 3 29 1 0 0 0 0 4 13 1 0 0 0 0 4 30 1 0 0 0 0 5 16 1 0 0 0 0 6 35 1 0 0 0 0 9 22 1 0 0 0 0 9 36 1 0 0 0 0 10 22 2 0 0 0 0 11 15 1 0 0 0 0 11 17 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 19 2 0 0 0 0 17 31 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M CHG 2 7 -1 11 1 M END $$$$