IFLAB-ZINC04033377 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0800 1.5300 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.0240 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.6320 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7290 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.9020 -1.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -0.0370 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 1.1740 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 1.8010 -3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 1.2300 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 0.0400 -3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -0.6140 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -1.7770 -2.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -1.9470 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -3.1280 -0.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8430 -3.0410 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -4.4560 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -5.4130 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -6.6200 -0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -4.7310 0.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -3.2830 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -5.3240 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -4.5430 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -5.1310 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -6.4960 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -7.2770 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -6.6930 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -7.2980 5.6910 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 1.9180 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.8820 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.8810 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0920 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -1.7110 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.1670 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -1.7060 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 1.6230 -3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 2.7430 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 1.7320 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 -0.3960 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -4.3280 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -4.8120 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.8290 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.8270 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -3.4770 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -4.5240 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -8.3430 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -7.3020 1.0370 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 3 2 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END