HMDB02318.mol Mrv0541 02231219292D 46 47 0 0 0 0 999 V2000 -1.0743 -3.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0743 -4.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3581 -5.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3552 -4.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3552 -3.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3581 -3.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7877 -3.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -3.9221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7877 -5.1597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3581 -5.9848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 -5.1569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7848 -4.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7848 -3.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4982 -3.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 -3.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 -4.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4982 -5.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 -3.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 -2.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4982 -2.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 -2.2690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9278 -3.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9278 -5.1569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4982 -5.9819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2435 -2.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8937 -2.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -1.9682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 -1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3552 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3552 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3581 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3581 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0714 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0714 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0714 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7848 2.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7848 3.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 3.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 4.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2116 3.0941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2116 4.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2116 5.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 4.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 5.9819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 5.9819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 7 8 1 0 0 0 0 2 9 1 0 0 0 0 3 10 1 0 0 0 0 4 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 12 17 1 0 0 0 0 5 18 1 0 0 0 0 18 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 17 24 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 25 27 2 0 0 0 0 19 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 2 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 43 45 2 0 0 0 0 43 46 1 0 0 0 0 M END