MMs02238561 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 38 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 -0.7576 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2576 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 -1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7424 -1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2423 -1.3297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2575 1.2683 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7575 1.2596 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1575 2.2988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0526 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7422 -1.3560 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.2422 -1.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9846 -2.6682 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.5846 -3.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4846 -2.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2270 -3.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5151 2.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0150 2.5454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1637 2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8636 2.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8363 -2.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1363 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6636 2.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3699 -0.4477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7013 -1.2268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0407 -0.1818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3722 -0.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8209 -5.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2422 -1.3823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2270 -3.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0271 -3.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7727 3.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3787 4.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4421 -1.3893 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 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 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 32 34 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M END