IFLAB-ZINC02698721 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 0 0 0 0 0 0999 V2000 0.3050 1.3100 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.1830 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.8870 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -2.2780 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.9670 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -2.2840 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.8920 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -4.7300 0.4540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -5.2270 -0.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -5.0800 1.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -5.2810 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -6.0090 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -6.2880 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -6.8130 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 -6.6670 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -5.9840 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -5.4460 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -5.5730 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -5.0340 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -4.3030 2.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -5.0060 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -4.1230 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -2.0640 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.9090 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -1.9330 5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -0.6590 5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -0.6950 6.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 0.4870 7.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 1.7150 6.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 1.7640 5.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 0.5840 5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 1.5720 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.7510 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 1.7550 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.3550 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.8120 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -2.8060 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.3590 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -6.2390 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -7.3580 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -7.0930 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 -5.8700 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -4.9300 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -5.3040 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -5.9300 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -4.5890 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -3.9290 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -1.8930 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -1.1020 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -2.4490 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -2.8760 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -1.7360 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.5520 6.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -1.6380 7.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 0.4530 7.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 2.6350 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 2.7250 5.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 0.6480 4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -6.4930 -1.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -2.7670 4.5700 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9870 -2.9300 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 39 1 0 0 0 0 12 59 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 59 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 60 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 23 60 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END