MMs02779498 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 0.7391 1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0218 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5217 2.5854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2608 1.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 -0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7608 1.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 -0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7607 1.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7389 -1.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2388 -1.3682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9779 -2.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2170 -3.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7171 -3.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9562 -5.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6953 -6.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1952 -6.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9561 -5.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9343 -7.8694 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0755 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2924 -0.8363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7070 0.6854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7606 1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2605 1.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0214 2.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2823 3.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7823 3.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0215 2.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0431 5.0953 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6087 -1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 1.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5695 3.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0912 -1.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5623 2.4510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8918 1.6685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8911 -1.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6078 -1.7565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9373 -2.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9036 -1.9098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8907 -3.4525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1258 -2.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7563 -5.2362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0866 -7.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1561 -5.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8518 0.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2213 2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1911 4.8594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8215 2.5326 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END