D0F6NT -OEChem-09301911112D 46 49 0 0 0 0 0 0 0999 V2000 5.5963 1.0094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8596 1.6785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 0.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8564 2.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8564 2.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1654 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5474 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 1.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 1.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 1.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8107 1.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 0.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0186 0.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5538 2.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9696 0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5049 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7128 0.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8254 0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6050 0.6276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 2.0602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5621 2.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7594 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7594 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -2.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2879 2.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -0.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7472 2.1444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 -0.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5578 -0.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4249 2.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 0.5598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0985 -0.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9656 2.1444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3024 0.5598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 9 1 0 0 0 0 2 17 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 8 2 0 0 0 0 6 9 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 13 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 32 1 0 0 0 0 12 15 2 0 0 0 0 12 33 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 16 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 24 2 0 0 0 0 20 39 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$