IBS-ZINC04816172 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.0080 1.4760 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.0520 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.5330 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -1.8660 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.6070 0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -2.4290 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -1.6040 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -3.7680 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 -2.0620 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -4.5250 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -5.9860 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -7.2820 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 -7.7590 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -9.1000 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -9.9980 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -9.5540 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -8.1910 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -7.4580 -0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -7.8220 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -6.1120 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -4.7900 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -4.5790 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 1.8370 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 1.7920 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.8870 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.4640 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.3680 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -4.3500 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -4.2160 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6730 -7.0680 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 -9.4660 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -11.0560 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -10.2610 -0.5730 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 26 1 0 0 0 0 2 27 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 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END