IBS-ZINC04870583 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8460 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.3920 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -3.7530 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.5930 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -4.0380 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.6760 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -6.0520 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -6.5310 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -6.9530 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4260 -7.3790 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -8.8630 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -9.5460 2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -9.3440 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -8.2710 -0.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1420 -8.2590 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -8.4650 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -8.1620 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -8.3410 -4.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -8.8210 -4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -9.1230 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -8.9410 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -10.6910 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -11.5800 0.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -12.8710 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -13.2880 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -12.3310 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -11.0560 -1.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -6.6580 2.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -1.7440 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.1770 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -4.6820 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.2460 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -7.7870 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -8.1050 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -8.9610 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -9.4990 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -9.1730 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -13.5910 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -14.3360 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -12.6230 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -6.4530 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 31 2 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 25 1 0 0 0 0 17 18 1 0 0 0 0 17 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 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 M END