0 mol 7 unq 0 iso 0 dist 7.15434 11.2706 7.10621 10.7937 8.72114 13.8829 15.6961 16.4405 22.1274 8.60435 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 4.92734 7.35767 8.96553 7.97177 8.53529 4.36226 10.6501 8.79272 11.2076 7.27018 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.4754 7.06064 9.62879 5.3298 7.18019 4.36226 10.0548 7.17012 11.2076 7.27018 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 6.57999 7.35767 9.62879 7.97177 7.18019 4.36226 10.6501 7.17012 11.2076 7.27018 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 13.4836 8.60554 8.52463 13.0079 11.2106 13.0257 4.90592 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.20058 16.6906 8.86116 13.4836 8.60554 8.52463 13.7923 5.97304 6.60423 9.36461 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 8.20058 16.6906 8.86116 9.04355 9.44691 13.4893 13.0079 11.2106 13.0257 8.16324 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 8.20058 14.9411 8.38394 13.4836 8.60554 12.3994 13.0079 11.2106 15.7639 4.90592 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 8.20058 14.9411 8.38394 13.4836 8.60554 12.3994 13.7923 5.97304 9.0934 9.36461 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 8.20058 14.9411 8.38394 9.04355 9.44691 12.505 13.0079 11.2106 15.7639 8.16324 numMergedOcc 0
10 mol 75 unq 0 iso 0 dist 8.2147 13.5815 7.79912 5.78327 9.81166 11.4997 5.50645 5.36954 11.1537 7.6433 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.62648 4.6251 8.73993 9.25614 6.52773 7.20179 7.20629 3.78311 7.77116 8.8562 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.62648 4.6251 8.73993 5.53673 9.23858 9.89358 7.20629 3.78311 7.77116 7.91683 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 6.24392 5.50061 6.06638 5.23583 6.30546 6.0268 9.31118 5.5703 9.46588 5.94233 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 6.23966 5.16275 9.61051 6.47522 6.28565 6.30169 13.8464 8.11992 15.6061 9.98397 numMergedOcc 0
15 mol 129 unq 1 iso 0 dist 6.23966 5.16275 9.61051 6.47522 6.28565 6.30169 12.3218 6.67948 15.3413 9.94578 numMergedOcc 0
16 mol 129 unq 2 iso 0 dist 6.23966 6.65856 5.83384 6.47522 6.28565 4.55551 13.8464 8.11992 10.0483 9.98397 numMergedOcc 0
17 mol 129 unq 3 iso 0 dist 6.23966 6.65856 5.83384 6.47522 6.28565 4.55551 12.3218 6.67948 8.03372 9.94578 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 8.99949 11.3502 6.85062 10.5805 8.70296 14.2045 14.4358 7.73656 13.311 6.48674 numMergedOcc 0
19 mol 209 unq 0 iso 0 dist 6.14896 9.80484 7.56373 5.78532 6.85935 6.552 9.93982 4.90038 8.41195 7.97418 numMergedOcc 0
20 mol 209 unq 1 iso 0 dist 9.12289 11.2544 7.56373 4.84945 6.85935 6.552 10.7597 4.90038 8.41195 7.97418 numMergedOcc 0
21 mol 232 unq 0 iso 0 dist 9.95045 12.5761 8.27212 4.95971 9.05071 8.80479 10.7483 14.8035 14.6969 8.28466 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.83775 4.66992 8.44326 4.36832 8.00673 4.97614 10.2559 6.54009 10.8604 7.21972 numMergedOcc 0
