MMs01694406 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.3014 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -2.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6076 -2.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3062 -2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2056 -2.9835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5023 -2.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8037 -2.9753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8084 -4.4753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1003 -2.2212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4017 -2.9671 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4017 -1.7671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6984 -2.2130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6937 -0.7130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2917 -0.7048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2965 -2.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9998 -2.9589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4733 -3.1348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9344 -2.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5819 -1.4414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9248 -0.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4610 0.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4065 -4.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1098 -5.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7079 -5.2130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5967 1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 0.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 -1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5943 1.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9368 -0.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 -4.1918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 -1.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0278 -3.6033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6128 -4.0373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -1.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2707 -1.3077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 -1.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6525 -0.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9865 1.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0036 -4.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9386 -3.9953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1051 -3.0587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5226 -2.1864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5171 -0.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0935 0.1793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9196 1.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4065 -5.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5065 -4.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0725 -5.8245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7131 -6.2585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1112 -6.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7490 -5.8097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3046 -4.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END