IFLAB-ZINC04939496 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0600 0.7230 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 1.5490 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 0.7370 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 0.6550 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -0.1120 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -0.8120 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -0.7370 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 0.0290 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -1.6030 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -1.8080 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1170 -1.3170 2.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7030 -2.6910 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0080 -3.3560 2.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1870 -4.0540 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3180 -4.2050 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7600 -4.5450 3.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 -2.9190 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4100 -1.8430 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9670 -0.3220 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1380 -1.3900 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5590 0.0450 7.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 1.3380 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 0.3320 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.1280 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 2.4140 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 1.9590 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 1.1870 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -0.1410 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -1.2710 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 0.0680 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 -2.0640 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -2.0680 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -3.4670 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 -3.4780 4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3830 -3.6030 5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 -2.3050 7.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -1.1820 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 0.3580 4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8910 0.2520 4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0060 -2.0190 3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2620 -0.9170 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7250 0.7180 7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3960 -0.4930 8.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5050 0.5910 7.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7930 -4.4180 1.2770 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.9120 -2.2810 3.6270 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.0840 -1.6950 3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 -0.9700 6.1300 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.4500 -1.5840 6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 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 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 46 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 48 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 46 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 48 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 45 -1 M CHG 1 46 1 M CHG 1 48 1 M END