PUBCHEM-ZINC05979261 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 1.5900 -0.2530 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.4080 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 0.9890 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 1.8360 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 0.5020 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 1.8370 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 1.7090 3.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 1.9310 4.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8970 1.1660 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 1.6650 5.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 1.8670 6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 1.4230 7.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 2.2320 8.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.8010 9.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.6410 9.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -0.1310 8.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 0.2090 7.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 2.4520 7.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 1.3580 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 1.0710 4.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 1.3820 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 1.1290 2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 3.2950 4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 3.7570 5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 5.1670 5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 5.4760 4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 4.3480 4.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.0530 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 0.7030 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -0.3080 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.3720 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -1.3490 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 1.5270 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 0.0180 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 2.7920 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 1.3320 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 2.0510 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.0280 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -0.1620 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 2.2450 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 2.5770 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 3.1710 8.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 2.3920 10.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -1.0680 8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.4750 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6930 0.9550 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 3.1540 5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 5.8740 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 6.4040 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 0.7330 -0.2580 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1120 1.5850 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 50 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END