RDKit 3D 84 89 0 0 0 0 0 0 0 0999 V2000 -3.1493 3.8975 1.5705 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8149 2.8988 0.6646 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5504 1.8010 0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7941 1.5470 0.8223 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5554 0.4335 0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -0.4193 -0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7733 -0.1713 -0.9923 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0155 0.9326 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7494 1.1581 -1.1915 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7867 -1.6084 -0.8763 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5122 -2.7818 0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0658 -3.1397 0.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5888 -4.0500 -0.8829 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2715 -4.4191 -0.9587 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3308 -3.8697 -0.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0019 -4.2344 -0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8027 -2.9618 0.8369 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9632 -2.3624 1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0663 -1.5387 1.3249 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2476 -1.1203 0.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3092 -0.2859 -0.3439 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 0.1073 0.6351 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3145 0.9916 0.3004 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5102 0.2561 -0.1508 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6192 1.1917 -0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3381 2.4950 -0.8094 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3622 3.3808 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0429 4.6997 -1.4361 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 5.2579 -1.4085 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6562 2.9364 -1.2133 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6936 3.8223 -1.5617 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9115 1.6194 -0.9239 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9183 0.7440 -0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2477 -0.6402 -0.2828 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0593 -1.4386 0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0227 -0.7052 0.8157 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6215 -0.0863 1.9627 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9889 -0.3089 1.9233 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9505 -1.1274 2.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1443 -2.5976 0.9022 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1757 -1.2549 -0.8828 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0276 -2.2256 -1.4895 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7068 -0.8180 0.3693 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8991 0.2175 1.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 4.8835 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5109 3.8764 2.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 3.9092 1.8879 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2546 2.2183 1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3061 -0.8383 -1.7321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2381 1.9614 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5389 -1.9281 -1.9197 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8686 -2.5259 1.0681 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1446 -3.6300 -0.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3021 -4.4991 -1.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8762 -5.1279 -1.6656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7138 -3.8909 0.4682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4804 -1.4812 -0.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4028 0.0096 -1.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5469 1.6904 1.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9063 1.6485 -0.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2722 -0.3139 -1.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3422 2.9226 -0.7841 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0299 4.6061 -1.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8078 6.2370 -1.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4001 5.3615 -0.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5053 4.7863 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9604 1.3107 -0.9805 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0441 -0.6275 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7071 -1.1319 -1.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3558 -2.3613 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5778 -1.8141 -0.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8801 0.9708 1.7626 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6091 -0.5937 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 -0.2285 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6673 -0.0073 2.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8337 -1.4413 3.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5029 -1.8750 1.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7816 -1.6724 -2.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4196 -2.8192 -2.2258 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5225 -2.9187 -0.7891 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8797 -1.7042 1.0373 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7423 -0.4368 0.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8216 0.0362 2.1626 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4152 1.2164 0.9846 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 6 10 1 0 10 11 1 0 11 12 1 0 12 40 2 0 40 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 36 1 0 36 37 1 0 36 35 1 0 35 34 1 0 34 33 1 0 33 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 27 30 1 0 30 31 1 0 30 32 2 0 22 38 1 0 38 39 2 0 17 15 2 0 15 16 1 0 15 14 1 0 14 13 2 0 10 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 8 3 1 0 13 12 1 0 44 5 1 0 39 19 1 0 25 24 1 0 32 33 1 0 1 45 1 0 1 46 1 0 1 47 1 0 4 48 1 0 7 49 1 0 9 50 1 0 10 51 1 6 11 52 1 0 11 53 1 0 40 77 1 0 20 57 1 0 21 58 1 0 23 59 1 0 23 60 1 0 24 61 1 6 37 72 1 0 37 73 1 0 37 74 1 0 35 70 1 0 35 71 1 0 34 68 1 0 34 69 1 0 26 62 1 0 29 63 1 0 29 64 1 0 29 65 1 0 31 66 1 0 32 67 1 0 38 75 1 0 39 76 1 0 16 56 1 0 14 55 1 0 13 54 1 0 42 78 1 0 42 79 1 0 42 80 1 0 43 81 1 0 43 82 1 0 44 83 1 0 44 84 1 0 M END