IFLAB-ZINC04139398 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.0880 -2.7700 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -1.8410 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -1.5850 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -1.9880 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -2.3280 2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -1.9050 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -2.0650 3.6190 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7240 -3.1600 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -1.5690 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -2.2800 5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -1.5110 6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.2370 6.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.0220 4.8800 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -1.6670 3.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8400 -2.1390 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 -0.1680 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -2.2370 4.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -3.6050 5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -4.3940 4.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -4.0970 6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -5.2940 6.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 -5.8070 7.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -5.1400 8.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -3.9410 8.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 -3.4240 7.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4170 -5.6740 9.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -2.6450 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.5530 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -3.8190 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -1.9320 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -0.7960 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -0.5000 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.9140 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -3.0620 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -1.4190 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -2.0320 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.4120 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.4500 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.8270 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -3.3080 6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -1.8710 7.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 0.5530 6.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 0.3530 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 0.0000 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 0.3050 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -1.6140 5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5460 -5.8330 5.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5330 -6.7330 7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -3.4080 9.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -2.5140 7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4260 -5.2660 10.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -5.4060 10.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4790 -6.7670 9.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -2.2300 -0.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0450 -3.2520 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -1.6650 2.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9980 -0.6440 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 54 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 56 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 56 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 26 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 54 1 M CHG 1 56 1 M END