IBS-ZINC05210347 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.1370 2.1410 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 1.0110 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.7410 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.2160 -1.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.6400 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -0.0400 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -1.8770 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -2.3490 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -3.4600 -3.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -3.9610 -3.7120 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6620 -3.9350 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -3.2120 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -1.9920 -4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -0.6770 -4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 0.1240 -4.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 1.1310 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0860 -0.6390 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 -1.9720 -3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 -2.9740 -3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8820 -2.6070 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1780 -1.2660 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2840 -0.2550 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -5.4320 -4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -5.7780 -4.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -2.5770 -2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -3.5870 -3.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -2.0030 -2.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -0.8790 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.5270 -1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 2.3180 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 1.9240 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 3.0720 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 1.3880 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 0.4630 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.0720 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 1.6330 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -1.8300 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -4.0460 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 -3.8530 -5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -2.9180 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -0.2510 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4480 -4.0230 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5890 -3.3780 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -1.0020 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5170 0.7880 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -2.4690 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 -6.1110 -4.0400 O 0 5 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 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 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 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 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 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 47 -1 M END