BL4KG2 -OEChem-04022103172D 39 41 0 0 0 0 0 0 0999 V2000 5.8076 3.8269 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -3.5981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4577 -2.8936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8076 3.8269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8076 3.8269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -1.8755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 -0.1731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8371 -1.6676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0281 -0.2663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 4.8269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -0.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 0.8269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 2.8269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6737 1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 2.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6737 2.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -4.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 -2.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -1.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -5.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7799 -4.8582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -4.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3446 -0.4831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4047 1.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2106 1.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4047 2.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2106 2.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -5.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5883 -4.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1903 -5.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9715 -5.4478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -4.7407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3446 5.1369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2707 5.1369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 -0.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 25 1 0 0 0 0 3 21 2 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 7 26 1 0 0 0 0 8 15 2 0 0 0 0 9 15 1 0 0 0 0 9 22 2 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 22 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 23 25 2 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 24 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 M END $$$$