MMs01009051 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 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 -1.4999 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2388 -1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4778 -2.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0222 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7611 -1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7388 -1.3310 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -2.8309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7516 0.1689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2387 -1.3438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9776 -2.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4776 -2.6620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2386 -1.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0640 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6997 -0.0640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 -0.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2608 1.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5219 2.5340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7607 1.2158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5218 2.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7829 3.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5440 5.1063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0439 5.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7828 3.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0217 2.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7606 1.1902 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -12.8050 6.3861 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1088 1.0213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0689 -3.6551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8465 -3.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1759 -3.8327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2591 -3.8419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6016 -3.0820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1512 -2.1486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1644 -0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8757 0.3688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2182 1.1287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3518 0.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5830 3.8240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9529 6.1507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9828 3.7779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 M END