MMs01539645 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 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 1.3045 0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3154 2.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5871 -1.5189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7942 -2.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3203 -3.8325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8203 -3.8216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3672 -2.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.9178 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -2.9134 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0265 -3.7619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8768 -4.3828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6011 -2.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9023 -0.9700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7231 -3.4350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1463 -2.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2683 -3.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1224 -5.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4971 -6.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4926 -4.9277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7332 -3.6342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2241 -1.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5466 -0.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9765 -0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0839 -1.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7614 -2.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3315 -2.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 -4.4329 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 -0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5924 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2652 1.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5153 2.2318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3241 3.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1154 2.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0166 1.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7782 -0.2359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0523 -4.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6358 -5.5584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2988 -4.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4822 -4.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5753 -1.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0865 -2.2155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0875 -6.0571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7551 -7.2217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6869 -5.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6607 0.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2346 1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2279 -0.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6473 -3.3242 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 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 9 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 M END