IFLAB-ZINC04163313 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -4.4910 1.1540 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -0.3510 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -0.6970 1.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -1.9880 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -2.8040 2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -2.4220 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -3.9490 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1430 -4.3040 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 -4.5350 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -5.0260 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -5.5640 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6180 -5.6110 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -5.1190 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -4.5770 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0060 -6.1980 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -4.3640 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -4.3960 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.9950 -0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.9240 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -5.3260 -3.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -4.9590 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -4.5430 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -4.7320 -1.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -4.5140 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -5.2780 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -5.4520 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -5.9960 -4.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -6.3670 -5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 -6.2000 -5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -5.6530 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 1.4130 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 1.6970 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 1.4220 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -0.6200 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -0.8950 3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -2.0750 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -1.9950 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -4.9900 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 -5.9480 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -5.1560 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -4.1900 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7340 -5.4130 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -6.6380 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -6.9690 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.6160 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -4.1290 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -6.1280 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -6.7900 -6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -6.4940 -5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 -5.5290 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 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 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END