IFLAB-ZINC04315773 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 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 0 0 0 0 0 0 0 0 0 0 -0.2410 -6.4730 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -7.4850 1.9270 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -9.0950 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -10.2700 1.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -10.3750 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -11.2860 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -10.6870 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -9.3610 0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -12.7390 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -13.6480 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -15.0030 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -15.4620 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -14.5640 2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -13.2070 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -17.1680 2.0990 Cl 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 2.3200 -2.3080 -4.0600 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 0.0380 -4.7580 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -4.7820 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -6.7080 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -6.6840 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -11.1930 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -13.2920 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -15.7080 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -14.9280 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -12.5080 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 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 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 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END