0 mol 7 unq 0 iso 0 dist 7.21217 5.07985 6.1206 13.2513 13.2247 9.87885 9.80599 5.44992 8.15894 10.2446 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.21217 5.07985 6.1206 13.2513 13.2247 9.87885 11.3438 4.74523 8.45544 12.3097 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 7.45487 9.29802 9.01112 13.9525 10.9495 6.56356 12.4302 7.17012 8.83742 5.7531 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 7.45487 9.29802 9.01112 11.9557 6.23795 7.62333 12.4302 7.17012 8.83742 6.31881 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 9.58625 3.30729 8.40422 11.0871 5.52198 8.40425 9.69745 8.79802 6.65534 5.88324 numMergedOcc 0
5 mol 89 unq 1 iso 0 dist 9.58625 3.30729 8.40422 10.458 9.1532 7.47974 9.69745 8.79802 6.65534 6.52312 numMergedOcc 0
6 mol 89 unq 2 iso 0 dist 9.58625 3.30729 8.40422 6.36021 6.50464 5.51831 9.69745 8.79802 6.65534 6.60299 numMergedOcc 0
7 mol 89 unq 3 iso 0 dist 9.58625 3.30729 8.40422 11.4742 6.54355 9.65149 9.69745 8.79802 6.65534 6.30713 numMergedOcc 0
8 mol 89 unq 4 iso 0 dist 6.36021 3.30729 5.51831 9.58625 6.50464 8.40422 9.69745 6.60299 6.65534 8.79802 numMergedOcc 0
9 mol 89 unq 5 iso 0 dist 6.36021 3.30729 5.51831 11.0871 8.46794 8.40425 9.69745 6.60299 6.65534 5.88324 numMergedOcc 0
10 mol 89 unq 6 iso 0 dist 6.36021 3.30729 5.51831 10.458 10.4087 7.47974 9.69745 6.60299 6.65534 6.52312 numMergedOcc 0
11 mol 89 unq 7 iso 0 dist 6.36021 3.30729 5.51831 11.4742 5.45013 9.65149 9.69745 6.60299 6.65534 6.30713 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.49205 8.22696 8.95212 12.6552 10.9871 6.99446 13.5178 13.52 9.57341 4.99056 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.49205 8.22696 8.95212 10.0583 9.93257 7.64052 13.5178 13.52 9.57341 3.78311 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 9.42766 16.57 7.64052 15.6032 9.93257 8.95212 10.1832 3.78311 9.57341 13.52 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 9.42766 16.57 7.64052 13.6653 4.85907 6.99446 10.1832 3.78311 9.57341 4.99056 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.89982 9.0696 6.59889 14.5119 7.65448 6.70693 12.0246 7.2238 7.1069 5.59336 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.75313 3.56689 8.08349 11.1179 10.3613 9.78218 11.4439 4.59567 8.54702 9.48743 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 6.08709 11.4272 8.08349 15.5817 10.3613 9.78218 10.3724 4.59567 8.54702 9.48743 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 7.2346 5.39025 5.1823 10.5214 7.218 8.19317 12.8892 6.65703 9.11454 11.5211 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.24313 12.4194 9.12776 16.0821 15.7907 9.72188 12.8147 11.0349 6.53286 10.7551 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 9.31417 13.338 9.72188 21.1413 15.7907 9.12776 17.0145 10.7551 6.53286 11.0349 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 5.56719 12.046 9.72188 19.8325 15.7907 9.12776 13.9848 10.7551 6.53286 11.0349 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 7.22789 8.41904 5.90058 11.8372 7.07277 5.90924 11.0283 9.09085 7.14086 4.48907 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 7.22789 8.41904 5.90058 17.6506 14.3597 9.58916 11.0283 9.09085 7.14086 10.1591 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 8.42412 6.34668 6.41303 11.8622 5.10183 9.19921 13.9344 8.63375 8.63754 10.8266 numMergedOcc 0
