IFLAB-ZINC04315294 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.5380 1.4230 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -0.0410 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -0.6310 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -1.9770 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.7580 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -2.2060 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.8280 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.2070 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -2.9870 -2.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -4.3320 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.1250 -1.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.8500 -3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -6.0670 -3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -7.4440 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.3920 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -8.4870 -4.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5310 -8.9470 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -7.0920 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -9.3330 -5.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -10.7060 -5.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -11.2820 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -11.1640 -7.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -12.4500 -7.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -12.5410 -8.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -11.3990 -9.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -10.1210 -9.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -10.0110 -7.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -8.8900 -7.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 1.9810 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 1.5660 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 1.8560 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.0410 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -2.4200 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -3.8020 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.3000 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -0.7020 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 0.8580 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.4860 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.9930 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -4.1650 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -5.4300 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -5.5770 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -7.3520 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -7.8700 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -8.0400 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -9.3840 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -6.5900 -5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -7.1540 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -13.3390 -6.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -13.5220 -9.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -11.5030 -10.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -9.2340 -9.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -6.2050 -3.6920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4470 -6.6290 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END