PUBCHEM-ZINC02506458 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.9800 -0.4650 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0090 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6420 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -0.2490 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -0.8910 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -2.3210 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -1.6750 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -0.1560 0.1620 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2120 -2.5000 0.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 -3.9000 0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4040 -4.5100 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4560 -5.9810 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5690 -6.7560 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2190 -8.0730 0.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8420 -8.8140 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -8.1980 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -6.9020 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 -6.7240 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 -7.8230 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -9.1040 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -9.2960 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 0.1230 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.5160 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.3490 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 0.5580 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -0.5860 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -3.1290 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -1.9770 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5460 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0300 -1.9860 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3150 -3.9380 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5780 -6.3840 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -5.7280 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -7.6870 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -9.9580 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 -10.2970 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 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 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END