MMs01493933 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7534 -1.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4932 -2.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2399 -3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -3.9069 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1388 -4.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5233 -5.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0858 -3.2848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2721 -2.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8133 -0.6257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8222 -2.4091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5836 -3.3672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4038 -2.1113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7263 -0.7730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9015 -2.1937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7218 -0.9378 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3218 -1.9771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1878 0.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3560 1.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6119 0.5846 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.0783 0.2690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5791 1.7312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2199 -0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0322 -5.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8238 -6.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1161 -7.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6169 -7.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8253 -6.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -5.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9534 -1.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6095 -3.6357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4466 -1.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1027 1.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6755 -4.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4452 -5.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8916 -1.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3106 -4.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6869 -3.8389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4435 -3.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1172 -0.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5369 1.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5097 2.2556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1136 2.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1540 -2.0614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4046 -1.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0231 -6.4648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7494 -8.8455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0508 -8.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -6.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2164 -4.7682 0.0000 H 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 33 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END