MMs02800508 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 36 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 1.3754 0.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5815 -0.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4123 -1.7835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9568 0.3055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1505 -2.0862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5731 -2.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4649 -1.3554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5934 -0.1346 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9649 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -2.6732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7257 -0.0752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2256 -0.0877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9864 1.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4864 1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2255 -0.1127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4647 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9647 -1.3930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7255 -0.1253 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.0248 -3.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4789 1.1003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1003 -0.4789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4789 -1.1003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7126 1.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 1.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0922 1.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1343 0.9690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3951 2.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0950 2.2267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0560 -2.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3561 -2.4272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8804 -4.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -5.1363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1691 -3.6307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 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 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END