MMs01137838 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.3028 0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9009 0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4989 0.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 2.2168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 0.7036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1046 2.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4075 2.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7027 2.1903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6950 0.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2931 0.6771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9826 -1.5662 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2778 -2.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2701 -3.8228 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3093 -3.2228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0521 -4.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5083 -6.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0083 -6.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4791 -4.7107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0055 2.9337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3727 2.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3821 3.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6387 4.7291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1699 4.4247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 -0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5362 1.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0789 1.6587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -0.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3647 -0.9364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1342 1.6533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6769 1.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4201 -0.9418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9627 -0.9497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 -1.2397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0685 2.8089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4136 4.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3860 -1.2530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9403 -2.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6939 -1.1973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4584 -2.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4574 -3.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9534 -5.1808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3333 -6.3707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6277 -7.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8768 -7.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1808 -6.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7674 1.2805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3399 1.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1805 2.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3565 4.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7374 5.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2737 5.8722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9699 4.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0506 5.6187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 M END