IBS-ZINC05562391 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 0.0460 1.6300 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.2600 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -0.6440 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.0240 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -2.9230 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -2.4050 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -1.0820 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -0.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 1.2040 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 2.1030 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 1.8450 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 1.2190 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 2.0290 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2860 1.4920 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 2.3590 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 1.8650 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9450 0.4870 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8420 -0.3810 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 0.1160 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3610 -0.0500 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3060 0.8010 -0.0800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7900 2.3240 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.1010 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.4080 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -3.9930 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -3.0510 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 3.1790 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 2.9510 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 3.0390 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 3.4340 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5350 2.5620 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 -1.4570 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -0.5830 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4970 -1.3130 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 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 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 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 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 2 0 0 0 0 M CHG 1 21 -1 M END