IBS-ZINC01468311 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -2.0250 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1040 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -2.6200 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 -2.0030 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1410 -3.0420 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4120 -4.1980 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 -5.0920 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -3.9220 0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6080 -2.9260 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1310 -1.8270 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3710 -4.0360 0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7680 -3.9260 0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.5040 -4.9950 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9720 -4.8790 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7670 -6.0300 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1430 -5.9150 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7410 -4.6560 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9580 -3.5120 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5770 -3.6150 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8110 -2.4940 0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4960 -1.2400 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0960 -4.5490 0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6420 -3.2290 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9180 -7.0340 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2400 -8.2920 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -3.7490 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 0.0410 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1830 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -0.9440 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9540 -4.9120 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0400 -5.9700 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3060 -7.0060 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4260 -2.5390 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1290 -1.1580 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1130 -1.1770 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7680 -0.4280 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7310 -3.2870 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2980 -2.7020 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3150 -2.6910 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9720 -9.0990 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6240 -8.3630 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6060 -8.3740 0.9870 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END