IFLAB-ZINC04850934 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.9290 1.2660 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.1100 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -1.1660 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -2.4560 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -2.7170 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -1.6550 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -0.3660 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -4.1370 -0.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4230 -4.8070 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -4.1880 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -3.7750 -0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -4.5500 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -5.6110 1.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -3.9890 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -2.8970 1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -4.8430 2.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -4.6570 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -3.5320 3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 -3.4130 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8010 -4.4300 5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 -5.5610 5.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -5.6690 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8450 -4.3090 6.7050 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.5570 -3.2950 6.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9570 -5.2280 7.5280 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2550 -6.1420 -1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -6.6530 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -5.1740 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -4.6270 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -7.0730 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 1.3860 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 2.0310 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 1.4450 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.9900 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -3.2520 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -1.8070 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.4410 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -3.5540 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -5.2090 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -2.8960 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -5.7020 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -2.7260 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 -2.5260 4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0950 -6.3630 6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -6.5540 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -6.1500 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -6.7510 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -7.6990 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -6.0870 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.5230 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 -5.1270 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -5.1970 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -3.5770 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -6.4990 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -8.1220 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -7.0440 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -4.7050 -1.5510 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5240 -4.1160 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -6.5600 -2.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 57 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 57 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 59 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 57 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 59 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 57 1 M END