MMs02772851 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 1.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7543 -1.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 -1.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5086 -2.5931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0086 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7371 -3.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0171 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2371 -3.9045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9828 -5.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2286 -6.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9743 -7.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4743 -7.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2285 -6.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4828 -5.2110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0198 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 1.5198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0049 -1.4802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2457 1.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7457 1.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7542 -1.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2542 -1.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5085 -2.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2628 -3.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7628 -3.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5085 -2.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4914 2.6129 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6423 2.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3577 -2.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1108 -2.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1204 -2.1914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8406 -2.8673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5828 -4.1668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3119 -5.7282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3068 -7.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8453 -8.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1787 -8.9865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -8.9901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6005 -8.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1452 -7.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1503 -5.7442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2784 -4.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6118 -4.8043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1167 1.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 2.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5334 2.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8719 1.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4166 0.8090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4217 -0.7337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3085 -2.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6662 -4.9111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3662 -4.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7085 -2.5595 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 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 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 41 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 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 M END