MMs01726205 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 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 -0.0677 -1.4985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1048 -2.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5773 -3.8382 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9212 -3.7705 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3198 -2.3245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5508 -2.0354 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6191 -3.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0652 -2.6897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1334 -3.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5795 -3.3441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9573 -1.8924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5573 -0.8532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4089 -2.2702 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2574 -3.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0311 -3.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7905 -5.0154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7025 -1.5109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0069 -2.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0177 -3.7514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3005 -1.4922 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.3398 -0.8922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6049 -2.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6157 -3.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9201 -4.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2137 -3.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2029 -2.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8985 -1.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2897 0.0078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -0.8394 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4429 -1.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7556 -5.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3096 -5.5930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1988 -0.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0542 1.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1988 0.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6411 -3.7837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1341 -4.1723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6939 -0.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5809 -4.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9288 -5.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2573 -4.3065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2378 -1.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8899 -0.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2462 0.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2468 -1.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3297 -0.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8239 -6.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5217 -7.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 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 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 33 2 0 0 0 0 32 48 1 0 0 0 0 48 49 1 0 0 0 0 M END