PUBCHEM-ZINC00627581 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.3710 1.4770 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.0380 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -0.7730 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -0.5300 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.1270 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.5840 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -1.4550 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -0.8610 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -0.4020 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -1.9430 0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -1.8990 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 -1.3340 2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2960 -2.5530 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4440 -3.6620 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -4.2540 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7960 -3.7530 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6520 -2.6730 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4050 -2.0690 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -1.0120 2.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1410 -0.3920 3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3370 -0.6620 3.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4820 0.6370 4.7210 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7370 1.1960 4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -0.1310 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1030 0.8030 6.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 1.7560 7.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8530 2.5440 6.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5040 1.6250 5.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.3170 1.0630 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1470 2.5700 4.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6060 2.5840 3.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 1.8270 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 2.0050 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 1.7760 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.2510 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -0.4660 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.5670 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -1.8570 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.2410 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -2.0360 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -0.7320 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 0.0610 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -2.3460 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -4.1030 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8090 -5.1100 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7740 -4.2100 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5370 -2.3310 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -0.6910 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -0.8040 6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -0.7730 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 0.2150 7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 1.3780 6.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 1.1880 8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6300 2.4480 8.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6090 3.1820 6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 3.2230 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1370 3.2350 4.7060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 M CHG 1 57 -1 M END