OTAVA-ZINC05376536 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0670 1.3060 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.2100 1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.6030 1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -1.9270 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.8280 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.1710 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -4.6310 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -3.7210 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -2.3770 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -1.4910 -0.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -2.0210 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -6.0630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -6.8710 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -8.3310 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -8.9990 -0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -8.8730 -0.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -8.0520 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -8.4200 -0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -7.4770 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -7.6850 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -6.7330 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -5.5710 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -5.3600 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -6.3080 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6570 -4.6350 -0.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4690 -3.4620 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -6.3960 -0.1740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 1.6050 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.8040 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.5870 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.4920 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.7090 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -2.4740 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -4.8700 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -4.0700 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -2.5190 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -2.7390 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 -1.2100 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -6.4720 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -9.8330 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -8.5890 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 -6.8930 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 -4.4540 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -6.1460 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -2.9470 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 -2.8000 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -3.7450 -2.1180 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 39 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 40 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END