IBS-ZINC02203201 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -0.1170 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -0.7230 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -0.1940 3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 1.3300 3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 1.9370 2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 1.4070 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 1.8520 3.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6970 1.0840 3.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -0.1960 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -0.6060 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -1.3920 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -1.8330 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -2.6290 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -3.0000 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -2.5770 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.7700 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -1.2850 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -1.5700 -1.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -0.3940 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -0.4460 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -1.8090 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -0.6250 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 -0.4700 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 1.6070 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 3.0220 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 1.6600 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 1.8390 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 1.6840 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 0.4270 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -1.5520 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 -2.9690 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -3.6250 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -2.8690 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 3.1700 3.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 3.4570 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 38 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 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 48 49 1 0 0 0 0 M END