MMs01085494 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 61 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 1.4238 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.2455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4118 2.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0132 2.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8767 3.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5252 5.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 6.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6319 7.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0234 7.6349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6591 6.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9141 5.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2632 3.6617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 3.7222 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7580 4.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6809 3.0571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8400 2.7466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5378 1.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7773 0.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1107 1.6483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3922 3.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7451 3.7232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0142 0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5029 0.6349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0881 2.0160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4065 -0.5625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8952 -0.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4803 1.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9690 1.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8726 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2874 -1.3921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7987 -1.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2246 4.8131 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 3.9303 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 -1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0281 -1.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 1.2534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 1.2247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3199 6.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0799 8.7626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 8.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8577 6.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9454 -0.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3659 -0.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5846 -1.5377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3109 1.2717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5423 2.2009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6174 2.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0378 1.7319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6904 0.8673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8794 -0.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4569 -1.6612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2255 -2.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7299 -2.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1504 -2.7233 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 35 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 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M END