95W Converted by convert_cif2sdf.py 2024/03/29 11:09:15 53 56 0 0 0 0 0 0 0 0999 V2000 6.4374 -2.1092 1.9640 O 0 0 0 0 0 5.5423 -1.4733 1.4387 C 0 0 0 0 0 5.8441 -0.3781 0.5930 C 0 0 0 0 0 7.2761 0.0138 0.3349 C 0 0 0 0 0 4.2538 -1.8099 1.6508 N 0 0 0 0 0 3.2646 -1.1072 1.0688 C 0 0 0 0 0 2.1069 -1.4220 1.2695 O 0 0 0 0 0 3.5375 -0.0607 0.2679 N 0 0 0 0 0 4.8317 0.3090 0.0221 C 0 0 0 0 0 2.4394 0.6853 -0.3519 C 0 0 0 0 0 1.6099 -0.2577 -1.2272 C 0 0 0 0 0 0.4299 0.5126 -1.8227 C 0 0 0 0 0 -0.3977 1.0583 -0.7385 N 0 0 0 0 0 0.3646 2.0036 0.0867 C 0 0 0 0 0 1.5445 1.2781 0.7398 C 0 0 0 0 0 -1.6139 1.6863 -1.2707 C 0 0 0 0 0 -2.5485 2.0128 -0.1346 C 0 0 0 0 0 -3.3724 1.0865 0.3183 N 0 0 0 0 0 -4.2098 1.3289 1.3128 C 0 0 0 0 0 -4.2463 2.5787 1.9187 C 0 0 0 0 0 -3.3943 3.5707 1.4677 C 0 0 0 0 0 -2.5284 3.2752 0.4237 C 0 0 0 0 0 -5.0399 0.3472 1.7461 O 0 0 0 0 0 -5.0476 -0.8294 1.0654 C 0 0 0 0 0 -4.0171 -1.7415 1.2435 C 0 0 0 0 0 -4.0267 -2.9361 0.5503 C 0 0 0 0 0 -5.0611 -3.2229 -0.3206 C 0 0 0 0 0 -6.0889 -2.3161 -0.4992 C 0 0 0 0 0 -6.0874 -1.1229 0.1960 C 0 0 0 0 0 7.9403 -0.6558 0.8795 H 0 0 0 0 0 7.4844 -0.0560 -0.7328 H 0 0 0 0 0 7.4381 1.0388 0.6694 H 0 0 0 0 0 4.0383 -2.5618 2.2245 H 0 0 0 0 0 5.0429 1.1500 -0.6212 H 0 0 0 0 0 2.8462 1.4889 -0.9659 H 0 0 0 0 0 2.2324 -0.6487 -2.0312 H 0 0 0 0 0 1.2370 -1.0832 -0.6210 H 0 0 0 0 0 0.8044 1.3291 -2.4402 H 0 0 0 0 0 -0.1712 -0.1594 -2.4347 H 0 0 0 0 0 0.7398 2.8133 -0.5393 H 0 0 0 0 0 -0.2833 2.4140 0.8618 H 0 0 0 0 0 1.1707 0.4773 1.3770 H 0 0 0 0 0 2.1179 1.9842 1.3396 H 0 0 0 0 0 -1.3497 2.6026 -1.7982 H 0 0 0 0 0 -2.1064 0.9999 -1.9595 H 0 0 0 0 0 -4.9316 2.7724 2.7312 H 0 0 0 0 0 -3.4014 4.5518 1.9193 H 0 0 0 0 0 -1.8502 4.0272 0.0487 H 0 0 0 0 0 -3.2080 -1.5168 1.9234 H 0 0 0 0 0 -3.2243 -3.6465 0.6883 H 0 0 0 0 0 -5.0667 -4.1582 -0.8624 H 0 0 0 0 0 -6.8971 -2.5430 -1.1799 H 0 0 0 0 0 -6.8931 -0.4161 0.0593 H 0 0 0 0 0 21 20 2 0 0 0 21 22 1 0 0 0 20 19 1 0 0 0 22 17 2 0 0 0 19 23 1 0 0 0 19 18 2 0 0 0 17 18 1 0 0 0 17 16 1 0 0 0 23 24 1 0 0 0 16 13 1 0 0 0 29 24 2 0 0 0 29 28 1 0 0 0 24 25 1 0 0 0 13 12 1 0 0 0 13 14 1 0 0 0 12 11 1 0 0 0 28 27 2 0 0 0 25 26 2 0 0 0 14 15 1 0 0 0 11 10 1 0 0 0 27 26 1 0 0 0 15 10 1 0 0 0 10 8 1 0 0 0 8 9 1 0 0 0 8 6 1 0 0 0 7 6 2 0 0 0 9 3 2 0 0 0 6 5 1 0 0 0 3 4 1 0 0 0 3 2 1 0 0 0 5 2 1 0 0 0 2 1 2 0 0 0 4 30 1 0 0 0 4 31 1 0 0 0 4 32 1 0 0 0 5 33 1 0 0 0 9 34 1 0 0 0 10 35 1 0 0 0 11 36 1 0 0 0 11 37 1 0 0 0 12 38 1 0 0 0 12 39 1 0 0 0 14 40 1 0 0 0 14 41 1 0 0 0 15 42 1 0 0 0 15 43 1 0 0 0 16 44 1 0 0 0 16 45 1 0 0 0 20 46 1 0 0 0 21 47 1 0 0 0 22 48 1 0 0 0 25 49 1 0 0 0 26 50 1 0 0 0 27 51 1 0 0 0 28 52 1 0 0 0 29 53 1 0 0 0 M END $$$$