IFLAB-ZINC04304119 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -4.1790 2.1020 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 0.6780 0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -0.0280 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 0.6390 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.0730 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -1.4520 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.1320 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -1.4110 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -3.6090 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -4.2130 -1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -4.2860 -0.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -5.7470 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -6.3520 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -5.7080 -1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -4.2740 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -3.5830 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -6.3410 -1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -5.8810 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2630 -6.5420 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8750 -7.6280 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6040 -7.9940 -3.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 -7.3770 -2.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8240 -8.3270 -3.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4490 -9.4660 -4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -10.2850 -4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -11.4100 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7070 -11.7230 -6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7200 -10.9110 -6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0970 -9.7870 -5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 2.5410 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 2.4540 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 2.3970 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 1.7180 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 0.4520 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -2.0060 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -1.9310 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -6.1380 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -5.9990 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -6.1890 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -7.4220 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -4.1400 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -3.8360 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -3.6300 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -2.5420 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5310 -5.0340 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2960 -6.2280 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7440 -8.0210 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 -10.0410 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -12.0470 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 -12.6040 -6.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2200 -11.1580 -7.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8910 -9.1550 -6.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 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 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END