0 mol 19 unq 0 iso 0 dist 7.20519 6.50337 7.16903 6.92532 12.3486 13.3939 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 4.54938 6.50337 10.2774 6.92532 5.18512 13.3939 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.864 6.50337 10.3465 6.92532 9.47529 13.3939 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.86116 6.07553 5.86882 6.72502 6.58998 7.43716 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.86116 6.48457 9.9259 6.72502 6.58998 6.79243 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.38394 6.07553 3.96228 6.72502 6.59374 7.43716 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 8.38394 6.48457 12.2071 6.72502 6.59374 6.79243 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 5.73819 9.07906 8.42544 8.60739 5.64171 13.8877 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 8.80331 9.89546 14.0634 9.93832 9.06158 9.01849 numMergedOcc 0
9 mol 43 unq 2 iso 0 dist 6.20293 9.07906 6.09486 8.60739 9.06158 13.8877 numMergedOcc 0
10 mol 43 unq 3 iso 0 dist 8.93915 9.07906 4.40385 8.60739 11.3891 13.8877 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 8.70481 5.62694 10.169 8.85586 14.8866 9.1484 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 8.70481 5.62694 10.169 7.11 8.05119 5.73042 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 7.95579 8.81824 6.62562 7.33422 6.82174 12.3035 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.19965 8.81824 5.46695 7.33422 7.91778 12.3035 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 7.66905 8.81824 11.3211 7.33422 10.121 12.3035 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 5.87555 8.86966 8.18329 8.28642 5.70788 13.6807 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 6.70283 8.86966 5.97115 8.28642 9.35627 13.6807 numMergedOcc 0
18 mol 152 unq 2 iso 0 dist 8.67331 8.86966 4.36394 8.28642 11.2078 13.6807 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.29945 6.62757 13.4456 5.4969 12.3408 3.87881 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.29945 6.62757 13.4456 6.4318 8.68081 9.0465 numMergedOcc 0
21 mol 175 unq 2 iso 0 dist 9.29945 6.62757 13.4456 7.35824 12.5754 11.923 numMergedOcc 0
22 mol 175 unq 3 iso 0 dist 9.29945 6.62757 13.4456 9.17364 10.0424 15.6544 numMergedOcc 0
23 mol 175 unq 4 iso 0 dist 9.29945 9.36354 14.5359 5.4969 12.3408 6.48813 numMergedOcc 0
24 mol 175 unq 5 iso 0 dist 9.29945 9.36354 14.5359 6.4318 8.68081 5.96325 numMergedOcc 0
25 mol 175 unq 6 iso 0 dist 9.29945 9.36354 14.5359 7.35824 12.5754 6.17754 numMergedOcc 0
26 mol 175 unq 7 iso 0 dist 9.29945 9.36354 14.5359 9.17364 10.0424 12.6929 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 8.02137 6.11803 7.25848 8.70977 6.3188 3.31862 numMergedOcc 0
28 mol 206 unq 1 iso 0 dist 9.774 6.11803 8.77621 8.70977 9.9412 3.31862 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 9.23153 4.96654 13.231 5.45036 6.17628 9.66008 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 9.23153 4.96654 13.231 9.97586 14.0253 7.48938 numMergedOcc 0
31 mol 220 unq 2 iso 0 dist 8.24498 4.96654 7.35133 5.45036 10.4136 9.66008 numMergedOcc 0
32 mol 220 unq 3 iso 0 dist 8.24498 4.96654 7.35133 9.97586 6.20511 7.48938 numMergedOcc 0
33 mol 234 unq 0 iso 0 dist 8.41436 9.18589 10.3659 9.007 8.16888 14.0827 numMergedOcc 0
34 mol 234 unq 1 iso 0 dist 8.92474 9.18589 10.4355 9.007 5.3211 14.0827 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 8.33025 6.38733 12.9824 7.50201 11.056 7.10224 numMergedOcc 0
36 mol 252 unq 1 iso 0 dist 8.33025 9.64349 15.2956 7.50201 11.056 10.1113 numMergedOcc 0
37 mol 252 unq 2 iso 0 dist 9.2288 6.38733 9.78504 7.50201 5.23748 7.10224 numMergedOcc 0
38 mol 252 unq 3 iso 0 dist 9.2288 9.64349 11.8272 7.50201 5.23748 10.1113 numMergedOcc 0
39 mol 252 unq 4 iso 0 dist 7.19638 7.48298 6.56535 6.86945 5.25252 5.52123 numMergedOcc 0
40 mol 252 unq 5 iso 0 dist 7.19638 8.9483 4.51829 6.86945 5.25252 6.95643 numMergedOcc 0
41 mol 252 unq 6 iso 0 dist 7.19638 6.38733 3.6688 7.50201 7.63376 7.10224 numMergedOcc 0
42 mol 252 unq 7 iso 0 dist 7.19638 9.64349 6.57801 7.50201 7.63376 10.1113 numMergedOcc 0
43 mol 258 unq 0 iso 0 dist 6.97229 5.8473 6.87078 8.15467 11.6066 7.5992 numMergedOcc 0
44 mol 258 unq 1 iso 0 dist 6.97229 6.78929 4.5427 8.15467 11.6066 13.9021 numMergedOcc 0
45 mol 261 unq 0 iso 0 dist 9.14619 9.00426 15.4874 5.26434 6.04016 9.46424 numMergedOcc 0
46 mol 261 unq 1 iso 0 dist 9.14619 8.19348 13.3429 5.26434 6.04016 7.48263 numMergedOcc 0
47 mol 272 unq 0 iso 0 dist 8.48753 8.97468 9.96676 9.05222 6.59863 4.61714 numMergedOcc 0
48 mol 274 unq 0 iso 0 dist 7.56915 8.98154 8.93097 9.56685 5.90436 13.5618 numMergedOcc 0
49 mol 274 unq 1 iso 0 dist 7.56915 8.98154 8.93097 8.49922 9.27829 16.1342 numMergedOcc 0
50 mol 274 unq 2 iso 0 dist 8.49997 8.98154 6.55065 9.56685 12.106 13.5618 numMergedOcc 0
51 mol 274 unq 3 iso 0 dist 8.49997 8.98154 6.55065 8.49922 12.9674 16.1342 numMergedOcc 0
