IFLAB-ZINC04939480 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -1.2240 1.0440 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -0.3580 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -0.8790 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -2.1680 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -2.9500 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4460 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -1.1430 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.1730 -2.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -4.4750 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -5.2210 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -4.9330 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -6.4460 -3.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4640 -6.8730 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -6.8430 -5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -7.6370 -5.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -8.0610 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -8.6260 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -9.5340 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -10.5580 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -11.0060 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -11.9900 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -11.4660 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -11.0300 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.7390 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 1.1300 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 1.3400 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -0.2800 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -2.5660 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -3.9450 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.7210 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -2.6720 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -4.5690 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -4.4470 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -7.5080 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -8.8510 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -7.8040 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -9.1780 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -10.4260 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -8.9800 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -9.7640 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -11.4010 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -11.4570 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -10.1570 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -12.2570 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 -10.6330 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -11.8750 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -10.5720 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -6.3760 -6.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6710 -7.1190 -3.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4270 -6.4450 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -7.6470 -4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -9.9970 0.0920 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5480 -9.1720 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 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 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 49 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 52 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 48 -1 M CHG 1 49 1 M CHG 1 52 1 M END