IBS-ZINC02299582 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.8190 -0.7080 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -1.1580 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -1.6180 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 0.0110 1.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2970 0.8360 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -0.4320 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -0.3840 1.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 0.4530 -0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 1.3320 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 1.8180 -0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 1.7050 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 0.8240 -3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 1.2400 -4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -0.5870 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 2.9840 -2.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 3.8440 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 3.5500 -0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 5.1470 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 6.0400 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 7.2540 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 7.5860 -1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 6.7050 -2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 5.4900 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -1.5400 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -0.3790 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 0.1170 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -1.9820 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -0.7940 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -1.9390 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -2.4510 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 0.1120 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 2.3050 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 1.0380 -5.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 0.6760 -4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -0.7230 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -1.2880 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.7700 -3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 3.2500 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 5.7820 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 7.9460 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 8.5380 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 6.9700 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 4.8050 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -0.8800 3.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -1.1520 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 44 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 44 45 1 0 0 0 0 M END