MMs00644808 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.3435 0.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5934 2.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0773 2.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 1.0221 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6729 -0.0276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 3.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2707 3.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9654 5.0874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1615 6.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6628 6.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9681 4.9613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4694 4.8983 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0746 2.4916 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5437 3.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9469 4.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9091 2.8445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3122 1.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7651 1.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8147 2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4115 3.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9587 3.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5556 5.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6052 6.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 6.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4612 4.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5337 1.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0748 -0.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5337 -1.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1644 5.1378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7173 7.4173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0197 7.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1179 1.2828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 0.2032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2692 -0.0663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7551 0.3483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5131 1.1222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 2.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3933 5.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2827 7.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8978 6.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6235 4.3157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 15 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 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 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 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END