IFLAB-ZINC04248523 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -0.6750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.0800 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7630 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.1030 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.7320 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -0.3550 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -1.4390 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.5360 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 -1.4380 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -0.6160 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -0.6150 1.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -0.1310 2.6390 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.9120 -0.2100 2.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -0.8230 3.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 1.5770 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 2.5400 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6960 3.8810 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 4.2640 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 3.2960 3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 1.9520 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 3.6500 4.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 4.9940 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 5.9370 4.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 5.5880 3.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1300 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -2.6150 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.8430 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -3.5640 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -0.9990 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -2.4620 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -1.0550 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 0.4080 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2150 -0.8990 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8280 2.2440 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3300 4.6310 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 1.1980 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 5.2320 5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 5.1020 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 5.8240 5.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 6.9680 4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END