IFLAB-ZINC04339826 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 4.2570 1.3680 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 0.0600 -1.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -0.6160 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -0.0830 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -0.8910 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -2.2320 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -2.7720 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -1.9570 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -4.1860 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -4.6250 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -6.0500 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -7.0210 -2.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -6.0400 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -7.0830 -5.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -6.7610 -7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -5.4140 -7.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -4.3510 -6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -4.7050 -5.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -3.8330 -4.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.9140 -7.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -1.3620 -9.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -1.1890 -10.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -2.3500 -9.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.5470 -8.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -0.9950 -11.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -0.5630 -11.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 0.5750 -10.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 0.4480 -10.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -5.0990 -8.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 2.0520 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.3570 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 1.7370 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.9530 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.4740 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.8460 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -2.3630 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -4.8890 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -8.1120 -5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -7.5670 -7.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -2.2240 -6.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -2.6930 -7.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -1.4890 -9.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -0.5120 -8.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -0.2550 -10.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -2.0080 -11.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -3.2430 -10.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -2.2760 -9.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.7210 -7.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -3.4920 -7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -1.9110 -12.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.1970 -12.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -0.2890 -12.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -1.3570 -11.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -5.9330 -9.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -2.6010 -8.4280 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9870 -3.4190 -9.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -1.1410 -10.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 55 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 57 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END