MMs00514898 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 36 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 0.0088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2576 -1.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5152 -2.5892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7575 -1.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7575 -1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0151 -2.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5152 -2.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2575 -1.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0151 -2.5453 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5150 -2.5365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3896 -1.3178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0397 -4.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8189 -1.7730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8277 -3.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4038 -3.7448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1311 -4.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4257 -3.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4169 -1.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1135 -1.0154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 1.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5938 1.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6212 -3.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9213 -3.6144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0422 -0.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3827 -0.8336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1381 -5.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4684 -3.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4526 -1.1517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 M END