B85TQO -OEChem-04042106013D 25 26 0 0 0 0 0 0 0999 V2000 4.1358 0.0776 0.3493 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8468 1.8446 0.1609 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 0.3683 -0.3911 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1236 1.6445 -0.3522 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 1.6296 -0.1814 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0017 0.5977 0.1958 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9400 0.0674 -0.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5053 -0.5088 -0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7305 0.2740 0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5984 0.3225 -0.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4301 -1.8999 -0.2201 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8706 -0.2421 0.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1965 -0.0858 0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8446 -2.4506 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -1.6390 0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3172 0.7202 -1.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0331 -0.9649 -0.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6526 1.3174 1.0526 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3047 -0.3419 1.5259 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3048 -2.5310 -0.3238 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3095 -1.1354 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6594 0.5361 -0.2304 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7439 0.0697 1.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9573 -3.5318 -0.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9383 -2.1273 0.2203 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 2 6 2 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 5 10 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 13 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 12 1 0 0 0 0 11 14 2 0 0 0 0 11 20 1 0 0 0 0 12 15 2 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 M CHG 2 1 -1 6 1 M END $$$$