MMs01789222 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.5000 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2503 -1.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5006 -2.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0006 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7497 -1.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4626 -4.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8328 -4.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9892 -6.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7755 -7.0084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 -6.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7511 -4.9062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9645 -4.0242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1058 -4.3948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -7.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1786 -6.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3923 -7.5504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2359 -9.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8657 -9.6526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -8.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7092 -11.1444 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.3594 -6.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5158 -8.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5731 -5.8560 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9433 -6.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1570 -5.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5272 -6.1955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6002 1.0391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0998 1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4503 -1.2982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9497 -1.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8038 -3.9301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3038 -5.4755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4885 -7.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2069 -9.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5558 -9.2595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -4.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -7.4611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8063 -7.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -4.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8283 -4.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4982 -5.4904 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END