MMs00756653 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -1.3011 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3053 -2.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6065 -2.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9034 -2.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8992 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4973 -0.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9468 1.5141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4131 1.8301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1595 3.1312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4059 4.4281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6595 3.1354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4058 4.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9058 4.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7909 3.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2162 3.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2120 5.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7841 5.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.4230 6.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4131 1.8385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9131 1.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6668 0.5373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1668 0.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1662 -0.5844 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0409 0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2678 -2.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6099 -4.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9443 -2.8361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5947 1.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7285 -1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2712 -1.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2059 4.4248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8029 5.4741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4233 2.0874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1890 2.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7150 7.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3919 6.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1311 5.1135 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 M END