IFLAB-ZINC04101419 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.0050 1.9280 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.4850 0.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4440 0.4660 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.1180 -1.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0920 -1.1240 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -0.3350 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -1.5260 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -1.3820 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.0880 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 0.9400 -0.8870 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 0.9250 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 1.6540 -3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 0.4940 -4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.2150 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 1.4780 -6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.3490 1.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.1790 2.2500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -1.8280 3.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -0.3040 2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -2.4420 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -3.5450 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -4.5300 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -4.4090 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -3.3160 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.3280 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -5.6170 -1.9760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 2.0100 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 2.5850 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 2.3190 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -2.4630 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -2.1860 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 0.3020 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 1.5990 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 0.0160 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 1.8020 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 2.6230 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 1.4330 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.1600 -5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -1.1860 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -0.4230 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 2.4260 -6.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 1.6390 -6.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 0.7980 -7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.3870 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.6430 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -5.3890 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -3.2320 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -1.4820 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.5890 -2.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 0.8260 -5.0450 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.0620 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 49 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 49 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 50 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 49 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END