IFLAB-ZINC04940893 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 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 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -2.7680 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -4.2260 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -5.1810 0.3810 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -6.5070 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -4.6560 1.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -4.8650 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -5.7000 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -5.4450 -1.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3190 -6.0750 -1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5930 -6.8540 -0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -5.8180 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5280 -6.4680 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4330 -6.2230 -3.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1190 -5.3350 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8960 -4.6870 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9850 -4.9190 -3.8800 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 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.4360 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -2.4450 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -2.4580 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -2.4490 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -4.6330 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -3.8070 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -5.1390 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -6.7580 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 -5.4260 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 -4.8230 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7750 -7.1620 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3890 -6.7260 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8300 -5.1480 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6570 -3.9950 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0330 -4.4090 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 M END