MMs03086770 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4120 0.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9181 -0.9060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -1.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9001 -2.5858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3639 -0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8398 -0.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3459 -1.7092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8218 -1.9770 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9732 -2.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7916 -0.8327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2675 -1.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9184 -2.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4048 -2.2504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2342 -3.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6726 -0.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3516 -0.0637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3067 1.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5827 2.2242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9036 1.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9486 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3279 -3.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8038 -3.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8578 1.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8276 2.5269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3819 1.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2677 1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4049 1.1296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1296 -0.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4049 -1.1296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6156 0.6183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2124 0.8191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7553 -0.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2076 0.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3498 -3.5086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2499 2.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5467 3.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9244 2.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0053 -0.5544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0436 2.3914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6477 2.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5081 0.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 -4.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7629 -5.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 43 44 1 0 0 0 0 M END