B5DAZ9 -OEChem-04012113162D 39 41 0 1 0 0 0 0 0999 V2000 3.4668 -0.2505 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4668 -0.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4668 -0.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4668 0.7495 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4374 2.2441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4155 2.4520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4668 -4.2505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3328 1.2495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4668 -1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6008 1.2495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2464 0.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 2.9132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6008 -1.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3328 -1.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9155 1.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6008 -2.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3328 -2.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 3.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4668 -3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 4.5605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 4.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9108 1.7865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0638 1.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2908 0.7126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3753 0.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0638 -1.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 -1.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5321 1.5211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0638 -3.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 -3.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4918 4.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 1.9977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2879 5.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 3.0817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7472 4.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9299 -4.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0037 -4.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 6 15 2 0 0 0 0 7 20 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 11 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 18 33 1 0 0 0 0 19 22 2 0 0 0 0 19 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$