MMs02112594 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 -0.5538 -1.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2485 -2.6614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -3.8161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -3.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0071 -1.7654 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3704 -4.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3093 -5.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5768 -6.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9053 -5.6692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9664 -4.1704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6989 -3.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7454 -2.7574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4108 -4.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5793 -5.3501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -4.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7393 -2.9492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2362 -3.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9016 -4.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0701 -5.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5732 -5.5419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7355 -6.9822 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0677 -1.7967 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1152 -0.4430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 1.1152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1152 0.4430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2465 -6.1205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5279 -7.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9192 -6.3110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7478 -2.1691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -1.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0992 -4.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9079 -6.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 33 1 0 0 0 0 M END