IFLAB-ZINC03864987 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7630 -2.3850 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -2.9380 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -4.4230 -1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -5.0530 -0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -4.2260 0.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -4.6360 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -3.8240 2.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -6.1050 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -6.2980 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -7.7880 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -7.9780 4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -7.0200 5.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -5.0540 -3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -6.4410 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -7.0240 -4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -6.2370 -5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -4.8610 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -4.2650 -4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -7.0460 -6.9910 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -2.4300 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.4080 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -2.5500 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -6.4980 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.6360 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -5.9050 3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -5.7660 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -8.1810 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -8.3200 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -7.0560 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -8.0970 -4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -4.2530 -6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -3.1910 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -9.2120 5.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -9.2840 6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 15 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 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M END