PUBCHEM-ZINC05748371 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -1.9520 -0.8850 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -1.7850 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -2.7790 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -3.6300 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -3.4960 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -2.5040 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -1.6520 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.5860 -1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 0.5670 -1.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -1.0520 -3.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -0.2690 -4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 1.0990 -4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 1.8430 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 1.2430 -6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -0.1280 -6.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -0.8910 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.2470 -5.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -3.0750 -6.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -2.8380 -7.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.4210 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -5.2130 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -6.4920 -5.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -6.9850 -6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -6.1980 -7.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -4.9020 -7.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -4.0850 -8.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 2.0590 -7.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4770 -8.8890 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7420 0.0950 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -0.7650 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -1.3040 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -2.8980 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -4.3940 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -4.1530 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -2.3840 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.0540 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 1.6180 -3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 2.9040 -5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -0.5690 -7.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6400 -4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -4.8520 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -7.1110 -4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -7.9870 -6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -6.6050 -8.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -4.0590 -9.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -4.5080 -9.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -3.0630 -8.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 3.2760 -7.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 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 27 28 1 0 0 0 0 27 48 2 0 0 0 0 M CHG 1 28 -1 M END