MMs02058495 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -0.5270 1.4044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6458 2.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8976 1.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5785 3.8381 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4607 3.2381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7528 4.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0169 3.7216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3483 4.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4156 5.9111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6124 3.6051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9438 4.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2079 3.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1406 1.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8093 1.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5452 2.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4047 1.1827 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3375 -0.3158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7361 1.8737 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8426 4.6455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6501 3.3814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 5.9096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1067 5.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1965 6.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6483 7.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4557 6.0636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 4.9050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6611 -1.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6838 1.7237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -0.8710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0235 5.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5646 5.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9632 2.5228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9976 5.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2730 4.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7555 0.1003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4801 1.5538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2696 7.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0867 8.4447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6536 5.9918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END