MMs02508780 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2548 -1.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7548 -1.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7451 1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 1.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4903 2.6037 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0224 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7548 -1.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0097 -2.5756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5097 -2.5812 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5153 -4.0812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2134 -3.3361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2548 -1.2682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0096 -2.5644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5096 -2.5588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 -3.8551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7645 -3.8494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5096 -2.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7548 -1.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2548 -1.2570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0096 -2.5420 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 15.7547 -1.2402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7645 -3.8382 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0045 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6587 -2.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3412 2.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8509 -0.2267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4135 -3.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6684 -4.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3684 -4.8864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3509 -0.2099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6509 -0.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END