MMs00227162 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.3003 0.7479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8983 0.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9008 2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4964 0.7393 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9485 -1.5049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4153 -1.8192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1674 -0.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1655 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4798 2.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6594 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5391 -1.5820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0311 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6435 -0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1356 0.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0152 -1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4029 -2.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9108 -2.6427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2985 -4.0120 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.7479 1.4652 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5983 1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5983 -1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5304 1.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0731 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4233 -0.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -0.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6532 1.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7313 3.2350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3065 2.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3306 0.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7389 0.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0492 -2.6775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9398 0.9136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2089 -0.9956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1066 -3.4604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 M END