PUBCHEM-ZINC03742465 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.7030 0.3900 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -1.0020 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -0.9480 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -0.9520 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -0.8840 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -0.8080 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -0.7960 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -0.8620 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.8150 -2.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -0.8270 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -0.7460 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -0.7280 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -0.6960 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 0.6700 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6800 0.7700 -1.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -0.6770 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -1.6240 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -1.5440 -6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.5330 -7.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 0.4430 -6.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 0.3580 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 1.4520 -7.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 2.2730 -7.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.5710 -8.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -0.4520 -9.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -1.2390 -11.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 0.3220 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 0.9580 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 0.9600 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -1.5600 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -1.5610 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.0040 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -0.8840 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -0.7400 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -0.9470 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -1.4670 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.4370 -4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -2.2860 -7.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 1.1060 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 1.6740 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 2.9120 -6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 2.9280 -7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -0.8490 -9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 0.6010 -10.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -1.1670 -11.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -0.8670 -11.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -2.2940 -10.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 1.5270 -3.8290 O 0 5 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 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 48 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 48 -1 M END