MMs01987071 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 1.3709 0.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9545 0.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1672 -0.5477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6137 -0.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3134 1.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7822 1.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5450 -0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8539 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3873 -1.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6888 -2.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4603 -3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9263 -3.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6173 -2.5714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2128 -2.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0799 -3.3961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0444 0.0100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0025 1.5094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0863 -1.4895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5438 0.0518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4590 -1.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8721 -0.6334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8302 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3913 1.2895 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2398 2.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8881 2.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4127 2.9734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4871 1.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0967 -0.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4871 -1.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7007 1.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 1.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7197 -1.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2538 -1.2693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2843 1.3305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8184 1.1679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6846 2.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3545 2.2707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8921 -4.9599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5575 -4.8807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8169 -2.5379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4370 -1.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9775 -2.2188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1543 -1.7998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0616 -0.4747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0267 0.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0469 2.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8603 3.8449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4577 4.9754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 18 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 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 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 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 49 50 1 0 0 0 0 M END