IBS-ZINC05025478 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 1.8470 1.0360 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -0.2850 0.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.8240 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -0.0860 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -0.6120 -2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -1.9010 -3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.6530 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1010 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -3.8680 -2.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -4.5780 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -3.9260 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -2.7380 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -2.4000 -5.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -1.1230 -5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -0.2530 -5.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -0.7750 -7.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 1.0880 -8.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 2.4280 -8.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 2.3900 -8.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 1.0300 -7.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -5.0260 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.9320 -5.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -6.1780 -4.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -7.2460 -5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 1.0480 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 1.7240 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 1.3450 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 0.9090 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -0.0340 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -2.6670 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -3.0850 -5.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -1.0520 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -1.3190 -7.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 0.3490 -9.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 1.2310 -8.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 3.2640 -8.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 2.5040 -10.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 3.2070 -7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 2.4480 -9.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 1.1300 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 0.2830 -8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -8.1100 -4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -6.9280 -6.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -7.5130 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 0.6690 -7.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END