MMs01053901 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 1.4269 0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6398 -0.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 0.4607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3915 1.8877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8915 1.8887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2802 -0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3957 0.9991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8219 0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1327 -0.9329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0173 -1.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -1.4713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5590 -1.3975 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -2.8237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0235 0.0288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9852 -1.8620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1007 -0.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7899 0.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9053 1.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3315 1.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6424 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5269 -1.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0686 -0.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2828 0.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4957 -0.7871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0311 -2.2134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5311 -2.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 1.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1415 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -1.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6389 -1.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7143 1.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2659 -3.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6987 -2.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2339 -3.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6489 0.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6567 2.7851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2239 1.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7756 -2.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2836 1.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6372 -0.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 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 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END