MMs00842864 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.2999 -0.7486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3015 -2.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0033 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3047 -5.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -4.4972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6013 -2.9972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8996 -2.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1994 -2.9944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4976 -2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -0.7429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7975 -2.9915 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7975 -1.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 -4.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0990 -5.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3972 -4.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3956 -2.9887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 -2.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6938 -2.2373 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4452 -3.5355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9424 -0.9391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9920 -1.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5989 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5989 -1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -2.4011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0337 -5.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -6.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6428 -5.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1272 -1.3274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 -1.3257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2007 -4.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6171 -4.2844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3899 -5.6196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3286 -6.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8713 -6.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8088 -5.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5787 -4.2791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3234 -1.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8661 -1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5931 -2.5245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0306 -0.8848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3909 -0.4473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END