MMs02157967 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.4228 -0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1249 -1.9450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1249 -3.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5361 -1.6685 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8467 -2.8276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9131 -0.3040 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0062 -1.9665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9993 -0.8423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4694 -1.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9464 -2.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 -0.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4096 -1.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8797 -2.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8728 -0.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3958 0.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9257 0.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2396 -2.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3823 -4.0613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1742 1.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3799 1.1383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1383 0.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3799 -1.1383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5672 -3.0833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0298 -2.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6177 0.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4389 0.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9015 1.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6152 -2.6356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2613 -3.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0489 -1.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1903 1.4114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5441 1.9478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3576 1.2033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9753 2.1877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0092 0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4309 -2.6827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5677 -3.8749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4614 -1.6979 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 38 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 40 -1 M END