IBS-ZINC02726694 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5040 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 0.1210 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.5980 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 0.0740 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4500 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.1720 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 2.1260 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 3.3440 0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 1.3180 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -0.0630 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -0.7730 -0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -0.6360 -0.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -1.6390 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 1.9680 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 2.0850 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9240 2.8610 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4220 3.0890 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 2.6900 3.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 3.7980 3.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 4.3610 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0930 5.5410 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 5.0360 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 4.0930 4.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4770 4.5850 5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 2.9110 5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2190 1.9070 4.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 2.0610 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.3980 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -1.6740 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 3.2500 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 1.4040 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 2.9660 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 2.5910 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 1.0860 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7010 2.3260 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7740 3.8420 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1120 3.5980 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7870 4.6630 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9890 5.8540 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4100 6.3970 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3650 4.5160 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4730 5.8590 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0270 3.1220 6.3990 O 0 5 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 43 -1 M END