IBS-ZINC01790630 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -1.8850 2.2000 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.8960 0.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.0940 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -1.1460 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.7870 -0.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 0.4190 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 1.0930 -1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 0.4660 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 1.4200 -4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.7660 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 1.7190 -6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 1.1080 -7.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.2830 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.3570 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -3.3630 3.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -1.3460 3.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -0.2140 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 0.6960 3.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.4760 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.7920 5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 0.5220 5.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 1.1510 5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 0.4650 5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -0.8490 5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -1.4800 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -3.1330 4.5870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -3.4070 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 2.9300 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 2.5220 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 2.1190 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 1.9830 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 0.2460 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.4590 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 1.6400 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 2.3460 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.5450 -5.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -0.1600 -5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 1.9390 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 2.6450 -6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 1.6570 -8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -1.0120 5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.5320 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 1.0580 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 2.1770 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 0.9570 6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -1.3840 5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.2790 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -4.3380 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -3.4390 -0.5460 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 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END