IFLAB-ZINC05145513 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -1.8100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.9130 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -4.3930 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -5.7220 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 -5.9320 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 -4.8030 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -3.4140 0.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3260 -4.7230 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7660 -7.2980 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -6.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -7.2690 1.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -7.3050 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -8.3830 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6790 -4.7090 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 -3.8120 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7410 -5.5900 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 -7.6330 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 -7.2470 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -8.0010 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -8.6870 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -8.0410 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -9.2310 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 M END