MMs03828722 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.5000 0.0062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5108 -2.5918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7554 -1.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 -0.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0605 -0.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0667 -2.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6421 -2.4933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2839 -2.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6517 -2.2847 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9538 -3.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0644 -2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4486 -0.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9574 -0.8162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5329 -2.3267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5319 -1.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0625 0.2168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0004 -1.5136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9995 -0.3947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4680 -0.7005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9374 -2.1252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4059 -2.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4050 -1.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9355 0.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4670 0.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9976 1.8430 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2564 1.0735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0284 0.1855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4242 -3.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9591 -3.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0842 -4.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0442 0.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9084 -3.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9792 0.2369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4444 0.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1382 -3.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7815 -3.5706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5798 -1.5567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7348 1.0077 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 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 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 M END