IFLAB-ZINC03866372 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.3110 0.1630 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.1320 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -1.3340 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -0.2430 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 1.0560 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 1.2570 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -0.4760 -0.3480 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3470 -1.5500 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 0.1720 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 1.2660 -1.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 0.0720 0.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -0.5490 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -1.6820 1.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 0.2190 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4120 -0.4990 3.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 0.1730 4.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 1.5690 4.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4630 2.2960 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 1.6190 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 2.4220 5.4780 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 3.7160 5.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5080 1.5060 6.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 2.6540 4.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7840 3.6390 3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2210 4.0660 3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1080 2.8620 2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0170 1.8280 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5680 1.4340 4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 0.3190 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -1.9860 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -2.3500 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 1.9180 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 2.2660 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 0.9510 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -1.5870 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8670 -0.4020 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 3.3840 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 2.2030 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3330 3.1950 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2070 4.5290 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2390 4.7610 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 4.6020 4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7970 2.4060 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1470 3.1860 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5990 0.9390 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4630 2.2430 4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5520 0.7410 5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 0.9240 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -0.4670 -2.6810 O 0 5 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 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 49 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 49 -1 M END