MMs01090536 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 69 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 -0.7551 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4897 2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2448 1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2346 3.9060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 3.9119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4794 5.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 6.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4691 7.8120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9691 7.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7242 6.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 5.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7345 3.9238 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3345 2.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2298 4.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2553 2.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7161 3.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1514 4.7235 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4620 5.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1260 5.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6652 5.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6398 6.5724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6123 5.0642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0476 6.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5084 6.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5339 5.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0985 4.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6377 3.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9947 6.0862 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.0394 1.4630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7434 0.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9735 -0.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8037 -1.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -1.1725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1748 0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3434 1.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8941 2.6813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5959 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9551 1.2913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6144 3.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4448 1.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1041 -1.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1053 4.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4383 5.0886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5243 6.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 8.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 8.8595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3242 6.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7815 2.0899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9074 3.1445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1310 6.4741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6547 6.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2273 7.3754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8567 7.9886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9188 3.4343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2894 2.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0340 0.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0924 -1.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9874 -2.9002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4701 -1.9249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0558 0.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7068 2.8550 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 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 60 1 0 0 0 0 35 36 1 0 0 0 0 35 61 1 0 0 0 0 36 37 2 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 38 39 1 0 0 0 0 39 64 1 0 0 0 0 M END