IBS-ZINC05477963 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -1.9680 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -2.6240 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -4.1460 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -4.5420 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9620 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -5.9220 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -6.6820 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -8.0720 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5300 -8.6080 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0570 -9.8960 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -10.0850 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2680 -8.9960 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7640 -7.7120 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3890 -7.5040 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6190 -6.3580 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -5.4580 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6120 -9.1980 0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0680 -10.5490 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -8.6180 0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -7.8640 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -6.5500 0.2100 N 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 -3.7800 -0.8840 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -2.2570 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -2.3040 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 -2.3300 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8730 -4.6160 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -4.4660 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -4.2840 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -4.2970 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 -10.7440 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8140 -11.0840 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4360 -6.8720 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1570 -10.5680 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6610 -11.1300 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7340 -10.9780 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -8.3350 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 28 2 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 26 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 M END