PUBCHEM-ZINC02747503 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.0070 1.2840 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.2350 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.6740 0.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -1.9990 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.7600 0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -2.4990 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -3.8100 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -4.2750 -0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -3.5650 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3650 -2.2340 0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 -1.6220 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -0.4410 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 -2.4500 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0210 -2.0750 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0690 -3.0800 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8850 -4.5060 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1180 -5.0250 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0230 -4.0580 -0.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4220 -2.8900 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -4.0550 -0.4380 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -1.6090 0.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0640 -1.1960 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -0.4620 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 0.7670 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 1.8200 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 1.6440 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 0.4090 -2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -0.6420 -1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 2.6780 -3.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -4.7380 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.6190 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.7620 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 1.5540 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.5040 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -0.7120 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2870 -1.0360 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9480 -5.0290 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3470 -6.0570 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9200 -1.9560 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 0.9040 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 2.7800 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 0.2690 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -1.6050 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 2.7350 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -5.1200 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -5.5700 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -4.1950 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 M END