MMs01335561 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -0.7438 -1.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2438 -1.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2561 1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7561 1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2438 -1.3239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7438 -1.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6312 -0.1217 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0556 -0.5919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0485 -2.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6197 -2.5487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1494 -3.9730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2578 -2.9793 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.6310 -2.3757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8403 -3.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6765 -4.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2135 -2.6595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.4229 -3.5469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7960 -2.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0054 -3.8307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8415 -5.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4683 -5.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2590 -5.0380 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -19.0509 -6.2092 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -16.9599 -1.4523 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1389 -2.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8389 -2.3517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 2.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1611 2.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1142 -1.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4466 -2.5066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9481 -4.8686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9745 -4.2170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9647 -1.3777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4981 -1.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3446 -1.4667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1039 -3.3479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3372 -7.1182 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 M END