IFLAB-ZINC02457761 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2110 -0.6820 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0320 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4180 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.8500 0.0140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 4.2750 -0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 4.2330 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 4.3300 1.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 4.5680 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 5.9890 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 6.1860 3.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 5.9480 2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 4.5320 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 6.5760 4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 6.7690 5.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 6.7740 5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 7.2080 7.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 7.3430 7.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -0.6140 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -1.9970 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -2.6850 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -2.0430 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 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 3.3040 1.9750 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 3.8470 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 4.4660 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 6.1180 3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 6.7130 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 6.0500 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 6.6690 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 4.4060 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 3.8080 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 7.5400 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 5.8370 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -2.4610 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -2.0860 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -2.5900 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -3.7390 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 7.4440 7.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 7.7210 8.7860 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 42 43 1 0 0 0 0 M END