MMs00732305 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 49 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 1.3049 -0.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -0.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -0.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 -0.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9781 1.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6731 2.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3801 1.5824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6612 3.8426 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 14.2711 2.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2592 3.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5523 4.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5404 6.1234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5748 6.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4964 6.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8572 3.8838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2949 -0.6367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3068 -2.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6118 -2.8763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 0.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5409 -1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0836 -1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1389 -1.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6815 -1.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4174 0.9543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 0.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 -1.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2795 -1.6116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8775 -1.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3349 -1.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7064 -1.8572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3361 2.1741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0792 3.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8399 4.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1234 -1.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9053 -3.2675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0200 -3.9202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6557 -3.4680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2035 -1.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0618 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0154 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 0.9871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END