IBS-ZINC05047051 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -1.9600 -2.6560 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -1.2260 -3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -0.3760 -3.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 1.3900 -5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 0.7890 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 0.6920 -4.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -0.6180 -4.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 2.2190 -3.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 1.5500 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 2.0290 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 1.6490 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 1.3430 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 1.0230 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 1.1460 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 1.5290 0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7090 0.9040 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -0.2750 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4240 -0.4950 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3850 0.4460 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0260 1.6170 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6850 1.8640 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3050 3.0810 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 4.0460 0.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 0.4800 -2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -0.0590 -1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -3.3050 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -2.9440 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -2.7550 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 2.6990 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 1.3480 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 0.7350 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 -1.0140 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7200 -1.4080 3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4230 0.2600 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7800 2.3440 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0930 0.0910 -3.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 -0.6210 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 3 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 36 37 1 0 0 0 0 M END