0 mol 13 unq 0 iso 0 dist 5.37391 5.07585 6.11444 6.80844 4.72753 6.02651 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 6.11016 4.20737 6.3902 10.0517 5.47667 9.3647 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.52295 4.99287 7.32236 11.1748 11.1757 7.67459 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.71891 4.68435 6.24688 6.30541 6.09549 6.11574 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 7.55822 4.0144 6.24688 6.14602 6.09549 6.11574 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 9.13829 7.77274 6.14769 11.8528 6.52836 8.8894 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 6.84082 7.77274 8.02616 11.8528 5.72591 8.8894 numMergedOcc 0
7 mol 120 unq 2 iso 0 dist 8.66256 10.778 8.02616 13.9957 5.72591 8.8894 numMergedOcc 0
8 mol 120 unq 3 iso 0 dist 5.90276 4.95 6.14769 11.0287 6.52836 8.8894 numMergedOcc 0
9 mol 120 unq 4 iso 0 dist 8.08194 4.95 8.02616 11.0287 5.72591 8.8894 numMergedOcc 0
10 mol 120 unq 5 iso 0 dist 9.89622 4.88697 8.02616 11.4409 5.72591 8.8894 numMergedOcc 0
11 mol 120 unq 6 iso 0 dist 8.565 8.23429 6.14769 10.1279 6.52836 8.8894 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.06801 4.81561 9.17101 12.9009 12.2127 9.27341 numMergedOcc 0
13 mol 174 unq 0 iso 0 dist 8.99695 8.91644 9.79225 18.3515 16.7408 9.56869 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 8.33743 13.0561 8.60727 15.7405 8.66522 5.17916 numMergedOcc 0
15 mol 242 unq 0 iso 0 dist 8.75712 5.22346 5.97464 9.3604 4.80103 9.035 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 7.81415 4.01355 4.1631 5.96202 8.33215 6.93798 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.08044 8.76196 9.82863 9.81303 4.70335 9.30394 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 6.08044 8.76196 9.82863 11.6123 9.38112 5.84467 numMergedOcc 0
19 mol 287 unq 2 iso 0 dist 8.8956 10.0477 9.82863 11.2663 4.70335 9.30394 numMergedOcc 0
20 mol 287 unq 3 iso 0 dist 8.8956 10.0477 9.82863 13.6444 9.38112 5.84467 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.08044 8.76196 9.82863 9.81303 4.70335 9.30394 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 6.08044 8.76196 9.82863 11.6123 9.38112 5.84467 numMergedOcc 0
23 mol 288 unq 2 iso 0 dist 8.8956 10.0477 9.82863 11.2663 4.70335 9.30394 numMergedOcc 0
24 mol 288 unq 3 iso 0 dist 8.8956 10.0477 9.82863 13.6444 9.38112 5.84467 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 6.08044 8.76196 9.82863 9.81303 4.70335 9.30394 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 6.08044 8.76196 9.82863 11.6123 9.38112 5.84467 numMergedOcc 0
27 mol 289 unq 2 iso 0 dist 8.8956 10.0477 9.82863 11.2663 4.70335 9.30394 numMergedOcc 0
28 mol 289 unq 3 iso 0 dist 8.8956 10.0477 9.82863 13.6444 9.38112 5.84467 numMergedOcc 0
