PUBCHEM-ZINC03686960 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.3480 1.5820 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 0.0700 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.4700 1.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -1.8350 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -2.7380 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -4.1160 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.6050 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -3.7160 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -2.3300 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.4330 3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -0.5910 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 0.0750 5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 1.0340 6.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 1.5060 6.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.0180 6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 0.0620 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -0.3850 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -1.2910 3.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -1.7830 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 2.4440 7.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 3.0110 8.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -0.4070 4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -1.5220 5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -1.3170 5.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -2.4560 6.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 1.8900 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 2.0500 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.9610 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -0.2100 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -0.2840 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -2.4040 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.8080 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -5.6770 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -4.1100 3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 1.4190 6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 1.3610 6.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -0.3100 4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 2.2520 8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 3.5280 7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 3.7550 8.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 0.5640 4.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -0.3720 3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -2.4950 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -1.5550 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -0.3620 5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -1.2560 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -3.4160 5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -2.5320 7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -2.2010 6.4220 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9240 -2.9590 6.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -2.1290 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -1.3270 6.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 M CHG 1 49 1 M END