IFLAB-ZINC02678704 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 0.3720 1.8500 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 1.2800 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 3.5060 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 3.7380 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 5.1620 1.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 5.6030 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 4.8180 3.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 7.0260 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 7.9020 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 9.2900 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 10.2740 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 11.5460 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 11.6260 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 10.0180 4.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 7.4850 4.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 7.0220 5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 6.1480 5.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 7.5760 6.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 7.1790 7.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 7.7000 8.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6930 8.6140 8.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 9.0120 7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 8.5020 6.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 0.7850 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 2.1960 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 2.3980 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.5560 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.2210 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.4680 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 4.0850 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 3.8220 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 3.4220 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 3.1590 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 5.7870 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 7.5410 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 10.0700 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 12.4200 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 12.5430 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 8.1360 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 6.4650 8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 7.3940 9.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 9.0190 9.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 9.7250 7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 8.8160 5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 2.0790 0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 45 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 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 15 16 1 0 0 0 0 15 39 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 M END