0 mol 8 unq 0 iso 0 dist 9.80352 7.80368 8.33604 14.9319 11.4716 8.53529 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.36326 8.64255 7.685 16.2657 12.9735 8.6653 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.08976 13.1105 8.82012 11.6455 4.98603 6.46104 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 9.5209 12.4304 8.68559 15.9404 7.14527 7.99969 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 8.9881 4.5514 8.68559 10.0514 7.14527 7.99969 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 8.45679 10.6596 7.20326 16.9126 9.79891 7.70232 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 8.45679 10.6596 7.20326 16.6993 9.97229 7.4671 numMergedOcc 0
7 mol 117 unq 2 iso 0 dist 9.0428 6.3368 7.20326 11.0881 9.79891 7.70232 numMergedOcc 0
8 mol 117 unq 3 iso 0 dist 9.0428 6.3368 7.20326 12.7478 9.97229 7.4671 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 9.02079 6.79537 9.12581 13.7244 10.0581 7.90048 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 9.02079 6.79537 9.12581 8.65287 7.20197 9.99802 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 7.08808 4.30841 6.88137 6.29351 5.69209 8.73722 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.22583 11.755 7.98142 15.6882 8.93991 5.94469 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 6.62037 5.49497 7.98142 8.83185 8.93991 5.94469 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 6.21461 5.49497 7.37327 8.83185 5.35588 5.94469 numMergedOcc 0
15 mol 182 unq 0 iso 0 dist 8.91389 4.61382 6.73313 11.0223 5.8726 6.73956 numMergedOcc 0
16 mol 182 unq 1 iso 0 dist 8.91389 4.61382 6.73313 11.0536 10.7622 7.09394 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.70674 12.9245 9.19704 18.1726 14.6029 6.03688 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 8.6925 16.447 9.59129 19.8486 12.1116 7.37798 numMergedOcc 0
19 mol 213 unq 1 iso 0 dist 8.6925 16.447 9.59129 16.3343 9.93085 7.73322 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 6.553 12.2372 6.16063 11.5096 5.70413 6.30154 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 6.553 12.2372 6.16063 9.33455 7.17691 7.32499 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 7.8126 10.8225 5.65339 12.6552 7.96337 6.21292 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 7.8126 10.8225 5.65339 11.4588 4.29892 6.95126 numMergedOcc 0
24 mol 235 unq 2 iso 0 dist 7.79898 11.3444 9.58736 9.22128 13.128 9.55668 numMergedOcc 0
25 mol 235 unq 3 iso 0 dist 7.79898 5.04474 9.43058 10.3528 17.5445 9.21736 numMergedOcc 0
26 mol 235 unq 4 iso 0 dist 7.79898 11.1685 6.98084 18.4939 11.921 8.69356 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 8.58887 11.959 8.14172 11.4496 4.38002 7.02333 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 8.58887 9.02336 6.77463 11.4496 4.38002 8.67864 numMergedOcc 0
29 mol 239 unq 0 iso 0 dist 9.2456 5.5592 8.1777 9.61914 5.91881 9.01021 numMergedOcc 0
