MMs01454811 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7466 -1.3010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2465 -1.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4931 -2.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9931 -2.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7465 -1.3169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -1.3248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7534 1.2733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2534 1.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0068 2.5664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2603 3.8674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5068 2.5624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2602 3.8594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5137 5.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2671 6.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7671 6.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5137 5.1525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7602 3.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5205 7.7506 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 -2.5981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3039 -1.8446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2902 -3.3515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7603 -3.8951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1538 -5.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2712 -6.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5682 -5.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2525 -4.0480 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0408 -0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4027 1.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1027 1.0257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0904 -3.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3904 -3.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3734 0.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7115 1.1614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0419 0.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3799 0.8559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1041 1.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3137 5.1636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6699 7.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7137 5.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3575 2.8147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0193 -5.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1489 -7.4615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6658 -5.9995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 M END