MMs00190412 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 1.5000 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2522 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7522 -1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7478 1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9975 1.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0025 -1.4899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2522 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7522 -1.2827 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1522 -2.3219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5043 -2.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0043 -2.5779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8840 -1.3629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5697 0.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6827 1.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1100 0.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4244 -0.8185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3113 -1.8241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3139 -3.3241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8881 -3.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5787 -5.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6951 -6.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1209 -5.7936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4303 -4.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2373 -6.7955 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 16.2231 1.6538 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6539 -2.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3539 -2.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3461 2.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6461 2.3410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0982 1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1252 -1.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4625 -2.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3774 -2.9928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7147 -3.7619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4278 0.4727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4312 2.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5663 -1.1874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4380 -5.6305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4475 -7.4337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5709 -3.9532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8982 1.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 31 50 1 0 0 0 0 M END