PUBCHEM-ZINC03645688 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 2.2200 0.4270 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 0.0060 0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1070 0.8900 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.8430 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.0650 -1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -0.1190 -2.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.7140 -3.7000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8120 -1.5720 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -1.1490 -3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.3580 -4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 1.5290 -4.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -0.1050 -6.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -1.0790 -6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 0.7130 -7.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4090 1.7450 -7.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 0.6110 -7.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 1.3370 -7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 0.8830 -7.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 1.5620 -6.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 2.7080 -5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 3.1740 -5.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 2.4990 -6.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 3.4150 -5.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 3.0490 -5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 0.1600 -8.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -1.0570 -8.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.8030 1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.2690 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 0.9250 2.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -1.3030 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -0.4470 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 1.0340 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.0150 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 0.8900 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.2940 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -1.6000 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.8840 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -0.4540 -7.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 0.9850 -8.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -0.0030 -7.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 1.1850 -6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 4.0690 -5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 2.9040 -6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -1.8050 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -1.7260 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -0.8350 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.1040 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 0.9810 -9.3660 O 0 5 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 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 30 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 CHG 1 48 -1 M END