PUBCHEM-ZINC02978605 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -1.4060 1.7480 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 0.2730 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.3240 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -1.6750 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.4350 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -1.8320 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.4820 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -4.1600 -0.2790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -4.6740 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -6.1730 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -6.5890 -3.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -7.8760 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -8.6920 -2.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -8.2950 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -7.3610 -6.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -7.7590 -7.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -9.0810 -7.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -10.0120 -6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -9.6260 -5.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -11.4240 -7.3110 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1370 -12.3200 -6.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -11.6910 -8.3430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0680 -9.5090 -9.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 2.3040 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 1.9450 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 2.0610 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.2670 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.1410 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -2.4200 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.0130 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -4.4690 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -4.1210 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -6.3790 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -6.7260 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -5.9380 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -6.3290 -6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -7.0370 -8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -10.3530 -4.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -9.5090 -9.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -10.5120 -9.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -8.8150 -9.9230 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 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 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END