IFLAB-ZINC04355009 MOE2007 3D Structure written by MMmdl. 54 58 0 0 0 0 0 0 0 0999 V2000 5.4890 -4.1100 12.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -3.6290 11.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -2.6220 10.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -2.1960 9.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -2.7820 8.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -3.8000 9.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -4.2210 10.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -2.3210 7.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -2.7470 7.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -1.9510 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -1.1170 5.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -1.3160 6.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.1780 5.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -3.2150 5.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.9160 6.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -3.7440 7.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -1.4630 3.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -2.1370 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.8350 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 0.2520 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.0390 3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.0140 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 1.4350 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.9750 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 3.3240 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 4.1450 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 3.6190 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 2.2710 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 -3.3020 13.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -4.4620 13.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -4.9300 12.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -2.1560 10.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -1.4050 8.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -4.2960 9.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -5.0200 11.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.3660 5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -4.7150 6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -1.7980 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -3.2280 3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -2.2060 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -2.2840 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.1980 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.3320 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 0.5050 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 0.3740 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.6240 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -0.3460 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 1.3540 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 3.7360 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 5.1940 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 4.2600 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 1.8840 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.3360 1.2830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8410 0.0910 1.4270 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 53 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END