IFLAB-ZINC04568863 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.3620 1.0360 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 0.6790 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 1.1290 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 3.4400 2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 2.9170 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 3.1350 5.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6620 3.0640 4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 2.2230 6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 2.7280 7.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 3.3040 8.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 3.4190 8.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 3.8530 9.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 5.0490 10.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 5.6170 11.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 4.9810 11.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 3.7820 11.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 3.2100 10.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 5.5280 12.6150 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 4.5950 5.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 4.9860 5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 6.3320 6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 7.2660 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 6.9010 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 5.5830 5.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 7.9700 5.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 9.0530 5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 8.6110 5.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.0040 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 1.1000 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 1.6260 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 0.7060 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.3670 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 1.0130 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 0.5440 4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 4.4690 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 3.4000 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 3.5250 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 3.0630 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 1.2420 6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 2.0630 6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 2.6680 7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 5.5460 9.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 6.5490 11.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 3.2990 11.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 2.2600 9.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 4.2430 6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.6320 6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 5.3380 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 9.7230 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 9.6110 6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 1.5040 1.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 2.5990 3.8330 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2040 2.6970 4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 51 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 52 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END