B7COD4 -OEChem-04012113042D 47 49 0 1 0 0 0 0 0999 V2000 6.6014 1.5648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.4694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0046 2.4136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 -1.2014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2657 3.0534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8958 -0.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 0.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 0.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -0.8967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6229 -2.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -0.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6229 1.3586 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5000 0.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6014 -2.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 0.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 0.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -0.8967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9551 2.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9121 -3.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2693 -1.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8906 -3.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2478 -1.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5584 -2.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0091 -2.2393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6023 -2.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7882 -1.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4785 -0.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8155 1.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9328 0.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7058 1.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8589 0.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 0.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -1.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -3.7701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0766 -1.0245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 2.1541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0832 -4.1042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6618 -1.3586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8517 3.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8724 3.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.4694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1651 -2.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 39 1 0 0 0 0 2 13 1 0 0 0 0 2 24 1 0 0 0 0 3 19 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 19 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 16 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 19 1 0 0 0 0 12 30 1 0 0 0 0 13 17 2 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 25 2 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$