IBS-ZINC06664109 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 0.0450 1.5940 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 0.0730 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9190 -0.1720 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.4910 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -1.2930 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.5040 -1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -1.6920 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -2.1820 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -1.3610 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.2220 -3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.9050 -4.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -3.1570 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -3.5880 -6.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -3.9600 -3.8650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -3.5470 -2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -4.2830 -1.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.1710 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 1.4410 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 1.8380 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 2.0140 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.0310 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.2600 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.3780 -5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -4.8560 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -0.1030 1.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 3.4950 -0.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 3.8190 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -0.4920 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M END