IFLAB-ZINC05257957 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 0.5200 0.7670 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6100 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -1.2450 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -0.5020 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 0.8760 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 1.5100 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -1.1940 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -1.9950 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -2.1120 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 -2.9130 -4.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1120 -2.0400 -4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0170 -3.0140 -4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6830 -1.7230 -3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0200 -0.8120 -3.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0160 -1.5810 -4.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 -0.3480 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9040 -0.3010 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4970 0.9180 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8150 2.0920 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5370 2.0490 -3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 0.8330 -4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8100 3.3080 -4.0380 N 0 3 0 0 0 0 0 0 0 0 0 0 11.3370 4.3800 -3.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6840 3.2710 -4.5010 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8290 -4.1550 -4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 -4.8590 -3.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 1.2630 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -1.1910 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -2.3210 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 1.4560 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 2.5870 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -0.6070 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -2.1840 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -2.9910 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 -1.4140 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -2.6930 -2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -1.1160 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 -3.8340 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 -3.1990 -5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 -2.3340 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4370 -1.2170 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4950 0.9550 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2810 3.0440 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9430 0.8000 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -1.3240 -0.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -1.8080 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -2.7830 -2.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0340 -2.2990 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9130 -4.4780 -5.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4590 -5.2840 -6.1230 H 0 0 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 32 1 0 0 0 0 7 33 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 45 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END