MMs01855612 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 1.5000 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7602 -1.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7395 1.3288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2396 1.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4793 2.6099 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 -1.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0205 -2.5503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2601 -1.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0204 -2.5264 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5203 -2.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2806 -3.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7806 -3.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2555 -5.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6306 -5.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7992 -7.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5928 -8.1994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2176 -7.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0490 -6.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8285 -5.2377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5202 -2.4906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7599 -1.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2600 -1.2095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6685 -2.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3685 -2.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3313 2.3728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5915 1.0917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0423 -0.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3844 -0.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5958 -5.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8993 -7.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7277 -9.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2525 -8.3132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3516 -0.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 2 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 M END