MMs03954261 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 -0.0344 -1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0688 -2.9992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4652 -1.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -1.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -0.1493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7536 -0.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5332 -1.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8132 -2.7123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3136 -2.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0328 -1.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7528 -0.0460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8124 -2.6434 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3121 -2.6090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7121 -3.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -1.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5317 -1.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4409 -2.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8565 -1.9555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8433 -2.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8221 -0.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3853 -0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0398 1.4344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1312 2.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5680 2.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9135 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0917 -3.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3717 -5.2064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 -0.0138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0275 1.1997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1997 0.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2685 -2.9717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0964 -4.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -3.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4514 -2.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6649 -1.5616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -0.9342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6303 0.8759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3296 0.9379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4369 -3.7374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7376 -3.7994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2364 -3.6961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8953 -0.9087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2133 -0.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0964 -3.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8903 1.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8548 3.6312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4412 2.8560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0630 0.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5913 -3.8561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2150 -4.8813 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 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 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 50 51 1 0 0 0 0 M END