IFLAB-ZINC01737580 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 1.8090 2.3670 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 0.8970 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 0.0570 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.4210 -1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -2.3380 -3.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3080 -2.2080 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -3.7890 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -4.3310 -2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -2.0920 -3.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.1760 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -0.4840 -5.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -1.1250 -5.7850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2570 -2.1490 -6.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -0.6120 -4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -0.2080 -6.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.7980 -8.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -1.5350 -8.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -2.0750 -9.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -1.8720 -10.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -2.4280 -12.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.1410 -12.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -1.3050 -12.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -1.0540 -13.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -0.8280 -11.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -1.1030 -10.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.5590 -8.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -3.3110 -12.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -4.6630 -12.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -5.5000 -12.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -4.9930 -13.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -3.6480 -14.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.8070 -13.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 2.5100 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 2.7710 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 2.9490 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 0.5340 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.7920 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 0.4420 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 0.1630 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -1.7450 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -1.5220 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -2.7130 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -0.5060 -5.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -1.2810 -4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 0.3790 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -1.6840 -7.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.6450 -10.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.5230 -13.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.0400 -8.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -5.0700 -11.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -6.5480 -12.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -5.6460 -14.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -3.2540 -14.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -1.7600 -13.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -4.2430 -1.9030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 55 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 2 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 25 2 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M CHG 1 55 -1 M END