MMs00037309 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 -1.5000 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2412 1.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4826 2.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0174 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7587 1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2587 1.2839 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7412 1.3241 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7312 2.8241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7513 -0.1758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2412 1.3342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9824 2.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4824 2.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2411 1.3543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0402 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5999 -0.9990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2586 -1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7586 -1.2739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0173 -2.5578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -3.8618 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4760 -3.8618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -3.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0348 -5.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7935 -6.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2934 -6.4599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0347 -5.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5347 -5.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7411 1.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4823 2.6684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 0.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9997 0.0804 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.7584 -1.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2584 -1.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0171 -2.4975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1069 -1.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0756 3.6513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6244 3.6332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8521 3.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1829 3.8214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2661 3.8286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6073 3.0663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6302 -0.3526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2994 -1.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2173 -2.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9765 -2.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6457 -3.4690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1104 -4.4108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1207 -5.9534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6686 -6.8879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0098 -7.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9004 -7.4950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3749 -0.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7161 -1.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6336 -1.6315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9747 -2.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9997 0.1006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.1996 0.1086 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 29 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 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 58 1 0 0 0 0 58 59 1 0 0 0 0 M END