IFLAB-ZINC04357426 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.1290 1.4410 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.0880 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.5480 1.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -1.8620 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -2.6730 0.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -2.3220 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -1.5090 3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -3.6400 2.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -4.0900 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -5.6130 4.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8500 -5.9550 4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -6.2280 3.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -7.6750 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -8.0010 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -7.4150 2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -6.0010 2.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -5.3160 4.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -3.9960 4.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -5.6280 2.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -5.9030 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -5.2840 6.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -5.7420 7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -6.8250 7.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -7.4440 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -6.9780 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -8.6200 6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -7.2780 8.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -6.5930 9.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 1.8090 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.7830 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.8220 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.4560 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -0.4690 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 0.0940 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -4.2900 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -3.6350 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7940 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -8.2220 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -7.9520 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -9.0820 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -7.5630 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -7.8650 3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -7.6280 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -4.4410 6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -5.2590 8.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -7.4570 4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -8.2720 5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -9.3230 5.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -9.1150 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -6.6540 10.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -5.5470 9.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -7.0540 10.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END