IBS-ZINC04751098 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.3590 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0040 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.6660 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0300 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4100 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0690 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8620 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 3.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 4.1200 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 4.3600 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 5.4190 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 6.2510 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 6.0320 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 4.9720 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 4.7380 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 3.8090 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 5.5550 -3.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 0.6350 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 0.5690 0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.3890 0.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 1.8650 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5530 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -1.7290 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 3.1310 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 3.7160 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.6010 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 7.0770 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 6.6860 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 6.2970 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 5.4010 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -1.3040 0.7560 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 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 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 31 1 0 0 0 0 M END