IFLAB-ZINC04518801 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.7010 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -1.1470 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -1.3840 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.1690 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7290 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -1.8620 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -2.0570 -4.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -2.4870 -5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.7280 -6.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5070 -6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -2.0850 -5.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -2.8190 -8.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -3.2100 -8.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -3.5530 -10.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -3.1640 -8.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -3.3970 -8.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.7410 -8.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.3200 -7.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -2.2420 -8.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -2.5840 -9.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -3.0060 -10.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -3.0780 -9.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -3.2800 -11.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -2.6330 -11.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -2.5930 -10.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -2.7030 -5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 -3.0950 -6.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 -2.4660 -4.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -0.5170 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -1.3110 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.3510 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.5660 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0540 -6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -1.9140 -7.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -3.4020 -10.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -1.6230 -11.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -3.2180 -12.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -2.1530 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7680 -2.6070 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 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 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 M END