IFLAB-ZINC05153302 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0760 1.0540 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3190 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -0.9200 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -0.1540 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 1.2150 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.8170 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 2.0880 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.3210 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -0.8530 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -0.6160 -0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3960 -0.7590 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -1.9730 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3050 -2.6540 -0.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 -3.8220 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 -4.3110 -2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8320 -4.5170 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7140 -4.0280 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -5.6860 -2.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3320 -6.3660 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 -7.6410 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 -7.6440 -4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -8.8230 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 -9.9580 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7740 -9.8790 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8210 -8.7420 -2.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 0.2660 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 0.4860 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 1.3350 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4020 1.8060 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 1.1590 -2.5590 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.5270 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -0.9210 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -1.9930 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 2.8900 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 2.3850 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 2.9780 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 1.8860 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 1.1700 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -1.1180 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -1.7610 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -2.5820 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -1.8240 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0100 -2.2630 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3360 -6.0760 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 -5.7160 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5220 -6.6000 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1980 -6.7410 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1460 -8.8550 -5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2080 -10.8930 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3640 -10.7590 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7470 0.0340 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0900 1.5970 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 2.4790 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 0.0180 -0.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 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 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 54 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 M END