IFLAB-ZINC04323181 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 0.2920 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -0.4830 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -1.5390 0.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -2.4380 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.5860 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -1.7100 1.7260 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -3.0830 2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 -1.1660 0.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 -0.6620 3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3450 -0.7360 4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 0.1110 5.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 0.2020 6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0380 -0.4180 6.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 1.0730 7.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 1.0000 8.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9470 1.8940 8.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0210 1.8280 9.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0480 0.8660 10.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9990 -0.0290 10.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9240 0.0420 9.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0970 0.8000 11.0150 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9760 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 1.0060 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 0.8250 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -0.9320 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 0.1940 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -3.0750 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -3.0540 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -1.0270 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 -2.2340 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 0.3700 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 -1.0100 3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4860 -1.7670 4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 -0.3880 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 0.6060 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 2.1040 7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 0.7250 7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 2.6440 7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8380 2.5260 9.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0190 -0.7800 11.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1030 -0.6530 9.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 34 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 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END