NCID-ZINC05758901 MOE2007 3D Structure written by MMmdl. 81 85 0 0 1 0 0 0 0 0999 V2000 -3.4110 2.1120 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 0.9790 -3.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4930 1.2890 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.3290 -3.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4620 -0.2070 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -1.4370 -4.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6020 -1.2110 -5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -1.5330 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -0.1660 -3.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3520 0.2060 -4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 0.7690 -2.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.3720 -2.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 0.8110 -2.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9010 1.6860 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 0.5450 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 1.5550 -3.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4750 2.5940 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 1.9880 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 1.1220 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 0.6580 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 1.0300 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.8680 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 2.3550 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 3.2250 0.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 2.2710 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 3.0190 3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 1.7940 4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 2.2070 5.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 1.7820 6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 0.9460 6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.5250 4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 0.9530 3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 0.5460 2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -0.1930 2.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.2870 4.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -0.7410 5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.1630 -0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 0.7760 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 0.7560 -1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 0.0160 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 2.2610 -4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -2.7160 -3.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -3.7640 -4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.7150 -5.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -5.0160 -4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -6.2520 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -7.4960 -4.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -0.7370 -2.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -0.4750 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 1.8930 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 3.0310 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 2.3050 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -2.2240 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.9730 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -0.4690 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.4870 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 3.2300 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 3.3190 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 3.3500 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 2.8620 5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 2.1020 7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.6430 7.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -1.3770 5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -1.3500 6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 0.0970 6.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -0.3710 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 0.7200 -4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -0.6310 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -0.6120 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 2.9650 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -2.8000 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -4.9680 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -5.0560 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -6.3770 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -6.1110 -4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -7.4260 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -7.7170 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -8.6600 -4.4180 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2140 -9.5180 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -8.5240 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -8.8320 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 42 1 0 0 0 0 8 9 1 0 0 0 0 8 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 30 31 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 35 36 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 66 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 41 70 1 0 0 0 0 42 43 1 0 0 0 0 42 71 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 45 72 1 0 0 0 0 45 73 1 0 0 0 0 46 47 1 0 0 0 0 46 74 1 0 0 0 0 46 75 1 0 0 0 0 47 76 1 0 0 0 0 47 77 1 0 0 0 0 47 78 1 0 0 0 0 48 49 1 0 0 0 0 78 79 1 0 0 0 0 78 80 1 0 0 0 0 78 81 1 0 0 0 0 M CHG 1 78 1 M END