MMs01084338 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 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 0.7781 1.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0565 2.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4431 2.6301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2212 1.3477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4996 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7208 1.3803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5759 2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0815 4.0289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0122 2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2947 2.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6097 2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6423 0.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3599 -0.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0449 0.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6287 0.1863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1963 -1.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9574 0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9900 -1.4839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2398 0.7938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5549 0.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5875 -1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9025 -2.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1850 -1.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1523 0.1288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8373 0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5000 -2.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7824 -1.3143 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5772 -1.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9778 1.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 3.6234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1221 -0.9933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2685 4.1582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6356 2.8594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -1.2405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2137 1.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5616 -2.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9287 -3.3487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1782 0.7512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8112 2.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5326 -3.5921 0.0000 O 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 16 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 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 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 36 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 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 2 0 0 0 0 M CHG 1 28 -1 M END