IBS-ZINC01733688 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 45 0 0 1 0 0 0 0 0999 V2000 0.4890 -0.3610 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 0.0280 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 1.5500 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -0.4680 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.9980 0.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0750 -2.3640 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -2.4860 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -3.1800 1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.4970 1.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -3.7240 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -4.4160 0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -4.2330 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -3.5400 3.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -5.4600 2.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -5.9590 4.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7060 -5.1320 4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -7.0120 3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -6.3560 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -5.3580 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -7.4310 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -6.5770 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -6.5990 4.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -0.0080 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -1.4460 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.0930 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.4260 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 1.8320 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.8950 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 2.0080 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.1030 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -0.0970 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.9430 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -6.0140 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -7.4470 4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -7.7960 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -5.8330 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -5.8810 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -4.8900 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -4.5920 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -8.0110 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -8.0920 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 -6.9570 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.1510 -0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -7.1030 6.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -7.4890 6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -2.4880 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 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 43 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 M END