D05NJI -OEChem-10101305032D 36 38 0 0 0 0 0 0 0999 V2000 7.6725 -2.1165 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8826 1.9286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0166 3.4286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6686 -1.1165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6725 -2.1127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6725 -2.1204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6763 -3.1165 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4244 0.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3797 0.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1506 0.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4244 2.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3797 2.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1506 1.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0166 0.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8826 0.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0166 2.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0005 -0.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7926 0.4217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8986 -1.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8007 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8196 0.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4224 -0.0757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1079 -0.2350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8622 -0.0671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 1.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4224 2.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8196 2.4494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8622 2.9243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1079 3.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4601 -0.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 0.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8962 -1.7607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2144 -3.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1406 -3.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 17 2 0 0 0 0 4 21 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 M END $$$$