MMs00679409 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 0.7460 -1.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0081 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7379 -3.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2379 -3.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9919 -2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 -1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9838 -5.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2298 -6.5022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4838 -5.2101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2298 -6.5115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4757 -7.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2217 -9.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7217 -9.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4757 -7.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7298 -6.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4838 -5.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9838 -5.2241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7298 -6.5255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2297 -6.5301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1152 -5.3194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5403 -5.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7566 -4.9094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5357 -7.2873 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.5749 -6.6873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1076 -7.7464 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.7464 -8.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5850 -9.6641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7958 -10.5495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0411 0.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5968 1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 -0.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2081 -2.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1346 -4.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1919 -2.6111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8492 -0.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2757 -7.8045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6185 -10.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3184 -10.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6757 -7.8213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8870 -4.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7479 -4.1770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2758 -7.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8989 -8.5071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2128 -10.2699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0837 -11.4629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 42 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 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 45 46 1 0 0 0 0 M END