MMs01831834 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.3048 0.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0202 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8379 -1.3133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3581 1.2730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8912 -0.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8795 -2.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1727 -3.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4775 -2.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4892 -0.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0605 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0872 -0.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4036 1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1105 2.1794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7085 2.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7201 3.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0249 4.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3181 3.6390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3065 2.1390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0016 1.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6229 4.3789 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.0755 -2.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3687 -3.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7707 -3.0604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 -0.5919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5919 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5406 1.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0833 1.6531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8357 -2.8721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1634 -4.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8033 1.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4265 -0.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6856 4.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0342 5.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3410 1.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9923 0.1992 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 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 36 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 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M END