IBS-ZINC04844484 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -1.9380 -2.4230 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -1.7210 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.5720 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -0.3620 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 0.6050 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 0.4920 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -0.5630 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -1.5300 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -1.4020 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -2.2020 -0.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -3.0310 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.2090 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 0.0300 2.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 1.2940 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 0.8490 5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 1.2530 6.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 2.7230 6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 3.6290 5.6880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2590 3.5380 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 3.2090 4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 5.0910 5.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -1.7850 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -3.3510 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -2.6820 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 1.4530 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 1.2400 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 -0.6350 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.3510 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 0.9450 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 2.1600 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 0.9430 5.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -0.1780 4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 1.0700 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 0.6280 7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 2.9900 7.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.8730 6.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 3.7860 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 3.3250 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 5.2490 6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 5.7440 5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 5.4080 6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 1.7560 4.0850 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9190 1.6310 4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 42 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END