MMs02556913 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 -1.5000 0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 1.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 2.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 1.2904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0099 2.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2649 3.8885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5099 2.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2549 1.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7549 1.2731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5099 2.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7649 3.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2649 3.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5199 5.1789 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.0099 2.5635 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 1.3134 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7392 2.8134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 -0.1866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 1.3192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4923 -0.1281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8098 -1.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5137 -2.3490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3951 -1.3496 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -1.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 3.6453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6139 3.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 0.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 0.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3509 0.2316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3689 4.9081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 2.3607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9079 -2.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3928 -3.5429 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 M END