MMs02595519 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 38 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 -0.7508 -1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -2.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2492 -1.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7162 -1.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8721 -3.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5014 -3.7144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2511 -4.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8316 -0.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2578 -1.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7205 -2.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 -3.7145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2205 -2.5025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6849 -1.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4719 -0.1938 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1118 -0.6136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2259 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9131 -3.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0272 -4.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4540 -3.6268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7668 -2.1597 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6527 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5993 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9508 -1.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 -3.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1007 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9109 -3.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5828 0.5637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3620 0.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7716 -3.4551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7769 -5.2630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3453 -4.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9030 0.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 24 35 1 0 0 0 0 M END