PUBCHEM-ZINC06871535 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.1540 1.4890 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.1540 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 1.6770 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 1.9750 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 2.1780 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 2.0850 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 1.8230 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 1.6240 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 2.2370 1.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6390 1.9380 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9860 1.3350 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2630 0.6900 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7350 0.9480 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5050 0.1750 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8620 0.4550 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4730 1.5060 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7100 2.2810 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3490 2.0060 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8040 1.6680 2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.4800 2.7160 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 3.7000 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 4.4670 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 5.7280 2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 6.4970 3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 5.8030 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 4.5540 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 4.3750 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5540 5.4390 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 6.6700 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0900 6.8770 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 0.7410 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.2720 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 2.4840 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 1.0070 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 0.2330 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.9810 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 2.0510 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 2.3990 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 1.7650 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 1.4150 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7620 0.2780 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 1.5880 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 0.9610 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0250 -0.3660 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0660 -0.6530 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4520 -0.1530 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1420 3.1080 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7790 2.6310 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0620 3.6930 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5260 2.7040 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4600 2.5560 4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 4.2310 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 3.4270 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 5.3030 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1900 7.4850 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 7.8390 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 1.4950 2.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.7230 2.4880 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7900 1.2570 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.4470 1.0800 N 0 0 0 0 0 0 0 0 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 1 60 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 60 1 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 57 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 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 M CHG 1 57 1 M END