0 mol 0 unq 0 iso 0 dist 9.16606 6.94181 5.85361 5.47921 11.788 7.15528 10.961 15.5953 10.4498 9.23213 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.16606 6.94181 5.85361 5.47921 11.788 7.15528 11.2375 10.7068 5.52201 8.81979 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.05125 7.15434 9.17482 11.2706 15.9303 7.10621 16.3188 18.4407 10.789 7.31201 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 8.05125 7.15434 9.17482 11.2706 15.9303 7.10621 13.7477 15.5773 10.515 9.36807 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.62469 9.17086 5.39546 5.90113 10.0804 8.80331 14.2386 12.9808 10.4442 9.83618 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.29755 6.54183 5.58127 5.65405 9.89662 8.10861 8.41365 10.1493 10.1332 5.02241 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 7.4038 6.54183 5.54544 5.65405 11.7963 8.10861 8.41365 14.043 10.1332 5.02241 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 8.09751 8.96916 12.7068 5.92158 9.27725 6.45675 12.237 17.7373 7.2495 8.72704 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 8.09751 5.70279 11.3776 5.92158 9.27725 7.47343 12.237 17.7373 10.1589 8.72704 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.47253 8.97043 10.1455 11.8721 17.1394 9.33865 15.3564 20.6371 10.7942 7.76729 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.47253 8.97043 10.1455 5.19652 9.54842 6.11741 8.77794 6.58408 10.8292 6.99777 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 9.47253 8.97043 10.1455 5.19652 9.54842 6.11741 13.7249 12.8137 6.12943 9.14376 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 9.63161 6.24392 4.7848 5.50061 10.2273 6.06638 10.8729 10.6827 7.01257 7.75534 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 7.21779 7.15087 9.15453 8.68855 10.1001 9.2313 9.15112 4.76541 9.49653 7.15475 numMergedOcc 0
14 mol 142 unq 1 iso 0 dist 7.21779 7.15087 9.15453 5.50176 9.78089 5.31024 9.15112 4.76541 9.49653 9.07935 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 8.3622 5.68636 8.78324 7.92939 14.5301 6.43582 16.0761 20.8466 12.1814 9.14392 numMergedOcc 0
16 mol 155 unq 1 iso 0 dist 8.3622 5.68636 8.78324 7.92939 14.5301 6.43582 10.6429 14.1617 6.34186 7.51198 numMergedOcc 0
17 mol 209 unq 0 iso 0 dist 6.74526 6.14896 7.34962 9.80484 14.282 7.56373 11.2201 12.1327 6.43758 9.52027 numMergedOcc 0
18 mol 209 unq 1 iso 0 dist 8.12326 6.14896 7.61997 9.80484 13.2724 7.56373 11.2201 13.5694 6.43758 9.52027 numMergedOcc 0
19 mol 209 unq 2 iso 0 dist 8.68691 9.12289 7.34962 11.2544 14.282 7.56373 15.2207 12.1327 6.43758 9.52027 numMergedOcc 0
20 mol 209 unq 3 iso 0 dist 7.37014 9.12289 7.61997 11.2544 13.2724 7.56373 15.2207 13.5694 6.43758 9.52027 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 8.18749 9.73411 11.2298 14.1073 18.8009 8.95269 17.4905 20.5638 9.36098 7.06793 numMergedOcc 0
22 mol 224 unq 1 iso 0 dist 8.18749 9.73411 11.2298 14.1073 18.8009 8.95269 14.0429 15.6375 5.29877 6.67585 numMergedOcc 0
23 mol 224 unq 2 iso 0 dist 8.18749 9.73411 11.2298 9.81806 14.526 6.57273 14.0429 15.6375 5.29877 6.65984 numMergedOcc 0
