IFLAB-ZINC04070107 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 2.0990 -1.9990 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -1.1570 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6970 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -1.0820 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -1.9290 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -2.3850 2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 0.1870 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -0.3530 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 0.4780 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8810 1.8520 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 2.3920 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 1.5620 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 2.6710 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 4.0750 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0300 4.8170 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0710 4.2050 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 6.1570 0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3420 6.8050 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1550 8.3210 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5520 8.6540 1.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 9.9710 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 10.3660 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 11.7040 3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 12.6510 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 12.2600 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6620 10.9230 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5770 14.0850 2.6020 N 0 3 0 0 0 0 0 0 0 0 0 0 8.0640 14.4300 3.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8770 14.9190 1.7680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7120 -2.3610 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -0.8570 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -0.0380 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -2.2300 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -3.0430 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -1.4230 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0450 0.0580 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 3.4620 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 1.9820 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 4.3930 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 4.2930 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9110 6.4580 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8820 6.5580 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1260 8.8110 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 8.6560 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 9.6270 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 12.0120 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6820 13.0010 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 10.6180 -0.0240 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END