IFLAB-ZINC04393904 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1600 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4540 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8360 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.6120 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.8290 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.2960 0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.1730 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -4.9920 0.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3390 -4.5070 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -6.3870 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -7.3240 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -6.6540 2.9670 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -7.5590 3.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -6.2030 3.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -5.2080 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -2.6050 -4.5930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -3.9100 -4.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -1.6610 -5.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -2.8040 -4.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -4.0310 -3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 -4.6280 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -3.5680 -4.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 -2.3790 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -1.7590 -4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2380 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1460 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.6900 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.5990 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -6.3190 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -6.7780 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -7.3030 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -8.3410 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -5.4390 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -4.3360 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -3.7950 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -4.7480 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 -5.4850 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -4.9470 -5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 -3.2320 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 -3.9980 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 -1.6350 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 -2.7190 -6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 -0.9770 -5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -1.3340 -3.5870 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 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 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 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 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END