IBS-ZINC00626860 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 2.0590 0.0940 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -0.8620 0.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -1.1480 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -0.5340 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -0.8250 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.7270 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -2.3420 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -2.0610 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -2.7120 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.3970 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -1.4330 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -1.1480 -1.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -3.0200 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -3.5040 -2.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -3.0550 -2.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -3.7490 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -3.9330 -4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -4.6180 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -5.1210 -6.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -4.9400 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -4.2610 -4.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -4.0380 -3.1100 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -2.6610 -2.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -4.6960 -3.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -4.8710 -1.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -3.5920 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -0.4360 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 0.6030 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 0.8280 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 0.1690 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.3460 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -1.9440 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -3.0430 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.6000 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -3.5400 -4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -4.7610 -6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -5.6560 -7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -5.3340 -5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -5.3580 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -4.8730 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -4.0160 -0.9000 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 11 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M END