MMs02228033 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 28 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 1.2940 -0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -2.2759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3628 1.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 1.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5734 0.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5623 -0.6538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 0.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9538 1.4951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4445 1.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0455 -0.0460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3342 2.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8250 2.3693 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0352 0.6069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5166 -1.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0592 -1.6830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4764 2.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3274 2.8512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7256 -0.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1391 -0.2457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 2.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2592 3.0692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6727 3.6873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 M END