IFLAB-ZINC02457311 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.2050 1.7840 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 0.4610 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -0.1630 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 0.5330 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 1.8640 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 2.4860 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -0.1590 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -0.8450 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -0.1490 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -0.7700 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 -2.0990 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -2.7840 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -2.1740 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -2.7000 -4.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 -3.7040 -5.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 -3.3250 -6.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -3.0540 -7.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -2.0310 -6.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3550 -2.4080 -4.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 -3.7530 -8.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -4.5900 -8.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7400 -3.4400 -8.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 -4.2780 -9.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7470 -3.9580 -10.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2320 -4.8260 -11.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 -4.4460 -12.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 2.2670 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.0860 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -1.1990 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 2.4210 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 3.5170 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 0.5650 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -0.8880 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 0.8910 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -0.1710 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -3.8260 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -2.7480 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 -4.6820 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -3.7940 -5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -4.1190 -7.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -2.4080 -7.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 -1.8760 -6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -1.0880 -6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -1.6190 -4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -3.3130 -4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -2.3770 -8.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 -3.6350 -7.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 -5.3460 -9.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -4.0900 -10.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8760 -2.9020 -10.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3510 -4.1510 -9.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9560 -5.8060 -10.8860 O 0 5 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 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 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 M CHG 1 52 -1 M END