PUBCHEM-ZINC06077972 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -1.7810 1.0320 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.3150 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -0.8320 1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.1790 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -2.6700 2.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -3.8540 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -4.4600 1.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -4.4140 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -5.6430 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -6.1630 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -5.4680 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -4.2450 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.7160 4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -5.9970 7.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -5.1540 7.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -3.8430 7.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -3.0060 8.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 -3.5120 9.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 -4.8980 9.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -5.6790 8.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -5.4500 10.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 -6.8360 10.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 -7.6050 9.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 -8.9740 9.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 -9.5790 11.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5770 -8.8200 12.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 -7.4470 12.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -6.6980 13.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 -7.3910 14.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 -2.6050 10.5800 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2570 -2.2170 11.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 -2.2480 10.3560 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2830 -1.5170 8.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 1.7480 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 1.4000 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 0.9070 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -1.0310 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -0.1900 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -0.1160 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -0.9570 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -2.8940 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -2.0540 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -6.1830 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -7.1120 4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -3.7080 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -2.7640 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -6.9560 7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3400 -4.8760 11.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 -7.1350 8.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 -9.5710 8.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6420 -10.6490 11.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7770 -9.2960 13.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -6.6780 15.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 -8.1220 14.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 -7.9040 14.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -1.1430 8.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 -1.0280 8.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -1.3030 7.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END