MMs01703869 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 0.2661 -1.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7717 -2.5592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0625 -3.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4137 -3.6148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2801 -4.4451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6168 -2.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9385 -1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9852 0.0799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2136 -2.2094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5354 -1.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8105 -2.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7638 -3.7894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1322 -1.5808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1788 -0.0816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4073 -2.3708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4465 -2.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -3.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7290 -1.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9321 -0.1754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4083 0.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1983 1.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6976 1.3192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4068 -0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6168 -1.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1175 -1.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0797 -2.3140 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7149 -5.2316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2579 -2.3561 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4170 -2.0455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8251 -0.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1769 -3.5416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2129 1.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7929 -0.5573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3349 -0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3782 -0.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2161 1.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9794 -0.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1612 -3.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3234 -5.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5601 -3.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6309 2.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3296 2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6063 -0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1842 -2.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7954 -4.7097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2368 -6.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3657 -5.7535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7143 -0.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2789 0.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -1.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3658 -3.3792 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END