IBS-ZINC04871593 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 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 0.9390 -1.9240 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -2.3630 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.5740 -3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.1350 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.4940 -4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.3480 -5.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -1.8940 -5.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -2.7220 -7.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -3.2750 -7.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -4.7280 -7.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -4.8080 -8.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -3.8610 -9.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -4.3070 -10.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -3.7480 -10.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -4.4670 -12.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -5.6910 -12.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -6.2670 -11.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -5.5590 -10.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -5.8280 -9.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -6.6230 -9.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -3.9090 -12.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -2.5940 -8.3810 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.4560 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -2.1520 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -1.8520 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -3.4410 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.3470 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.0420 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 0.9420 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6460 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -3.5430 -4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -1.9030 -4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -2.6890 -8.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -3.2420 -6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -5.0640 -8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -5.3610 -7.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -2.7950 -10.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -6.2130 -13.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -7.2220 -12.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -3.2960 -13.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -4.7280 -13.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -3.2970 -12.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.4610 -8.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.7420 -8.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -2.0210 -3.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 52 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 53 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 53 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 M END