0 mol 58 unq 0 iso 0 dist 6.40841 8.69057 11.0945 10.8779 16.0571 8.66539 4.55117 8.80108 7.03126 10.8078 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 6.40841 8.69057 11.0945 10.8779 16.0571 8.66539 13.3401 16.5169 9.68228 6.35371 numMergedOcc 0
2 mol 58 unq 2 iso 0 dist 6.40841 8.69057 11.0945 5.47421 10.335 5.38524 4.55117 8.80108 7.03126 5.98837 numMergedOcc 0
3 mol 58 unq 3 iso 0 dist 6.40841 8.69057 11.0945 5.47421 10.335 5.38524 13.3401 16.5169 9.68228 8.48255 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 9.02278 6.21799 5.5067 7.04035 14.5113 9.74228 6.11922 13.4823 9.14817 6.00418 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 9.02278 6.21799 5.5067 8.24309 12.0903 7.12321 6.11922 13.4823 9.14817 9.0131 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 9.02278 5.03251 4.01021 5.8486 13.0378 9.56773 6.11922 13.4823 9.76686 9.93049 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 8.624 9.74228 9.88768 5.36766 6.77912 7.12321 6.00418 9.19459 9.14817 9.0131 numMergedOcc 0
8 mol 72 unq 4 iso 0 dist 8.624 9.74228 9.88768 7.04035 11.9814 6.21799 6.00418 9.19459 9.14817 6.11922 numMergedOcc 0
9 mol 72 unq 5 iso 0 dist 6.77912 7.12321 9.88768 5.36766 8.624 9.74228 9.0131 9.19459 9.14817 6.00418 numMergedOcc 0
10 mol 72 unq 6 iso 0 dist 6.77912 7.12321 9.88768 8.24309 11.9814 6.21799 9.0131 9.19459 9.14817 6.11922 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.66954 6.39384 6.49835 7.69052 8.66155 9.42082 10.7942 12.4065 8.0168 10.9739 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 8.66155 9.42082 6.49835 7.69052 9.66954 6.39384 10.9739 12.4065 8.0168 10.7942 numMergedOcc 0
13 mol 115 unq 2 iso 0 dist 7.64585 6.39384 5.65471 7.69052 12.2309 9.42082 10.7942 6.40036 8.0168 10.9739 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.94837 9.00918 5.58312 14.069 11.0162 9.10524 5.9915 6.4218 5.73203 14.0644 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 8.94837 7.99477 9.61537 6.90348 13.0127 5.35237 5.9915 6.4218 6.57379 8.96357 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 8.62646 7.02548 6.24722 4.70068 10.5089 6.84752 6.36909 11.5173 7.30954 7.69326 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 8.62646 7.02548 6.24722 10.3445 13.6191 7.86563 6.36909 11.5173 7.30954 9.46955 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 7.98142 9.01624 12.2513 11.5866 16.7285 5.05973 6.7991 12.2455 6.76746 8.35755 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 7.37327 9.01624 14.8923 11.5866 18.3916 5.05973 6.7991 11.691 6.76746 8.35755 numMergedOcc 0
20 mol 219 unq 0 iso 0 dist 4.87541 4.33238 3.78261 7.02195 10.105 7.83604 4.74167 9.37299 7.30481 4.9853 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 5.50387 8.1945 3.92979 13.3965 9.88956 6.50998 10.7506 8.75834 8.91356 8.69249 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 5.50387 8.1945 3.92979 13.3965 9.88956 6.50998 7.12954 9.36396 9.59574 14.2819 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 10.2693 11.8897 5.64285 5.56749 8.49841 9.11572 8.0608 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 9.5707 7.81215 11.8229 10.2693 11.8897 5.64285 15.015 13.7038 9.49229 5.34613 numMergedOcc 0
25 mol 234 unq 2 iso 0 dist 9.5707 7.81215 11.8229 10.2693 11.8897 5.64285 12.1076 9.6101 7.20293 6.29366 numMergedOcc 0
26 mol 234 unq 3 iso 0 dist 7.85175 7.81215 10.5304 10.2693 13.0678 5.64285 5.56749 10.0446 9.11572 8.0608 numMergedOcc 0
27 mol 234 unq 4 iso 0 dist 7.85175 7.81215 10.5304 10.2693 13.0678 5.64285 15.015 15.6839 9.49229 5.34613 numMergedOcc 0
28 mol 234 unq 5 iso 0 dist 7.85175 7.81215 10.5304 10.2693 13.0678 5.64285 12.1076 10.7048 7.20293 6.29366 numMergedOcc 0
29 mol 234 unq 6 iso 0 dist 9.39181 5.64285 6.45373 10.2693 10.475 7.81215 8.0608 11.8534 9.11572 5.56749 numMergedOcc 0
30 mol 234 unq 7 iso 0 dist 9.39181 5.64285 6.45373 10.2693 10.475 7.81215 5.34613 10.5718 9.49229 15.015 numMergedOcc 0
31 mol 234 unq 8 iso 0 dist 9.39181 5.64285 6.45373 10.2693 10.475 7.81215 6.29366 5.32183 7.20293 12.1076 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 6.55759 9.12776 15.4844 15.7907 21.3432 9.72188 8.82861 11.4385 9.84652 15.5674 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 7.02475 9.12776 13.037 15.7907 17.436 9.72188 8.82861 6.65088 9.84652 15.5674 numMergedOcc 0
34 mol 238 unq 2 iso 0 dist 7.67322 9.12776 9.75095 15.7907 12.1104 9.72188 8.82861 6.5772 9.84652 15.5674 numMergedOcc 0
35 mol 238 unq 3 iso 0 dist 9.29858 9.72188 11.7938 15.7907 12.3367 9.12776 15.5674 10.9442 9.84652 8.82861 numMergedOcc 0
36 mol 238 unq 4 iso 0 dist 7.19008 9.12776 6.12722 15.7907 15.0465 9.72188 8.82861 6.17025 9.84652 15.5674 numMergedOcc 0
37 mol 259 unq 0 iso 0 dist 6.77938 6.9899 9.2872 9.98105 14.5785 5.85442 5.31048 11.4462 6.23661 5.79468 numMergedOcc 0
38 mol 259 unq 1 iso 0 dist 7.76676 6.9899 4.61451 9.98105 10.4634 5.85442 5.31048 9.64797 6.23661 5.79468 numMergedOcc 0
39 mol 292 unq 0 iso 0 dist 9.454 9.9182 8.68456 10.3106 13.8513 7.30758 9.98079 15.6736 9.08193 5.07048 numMergedOcc 0
40 mol 292 unq 1 iso 0 dist 9.454 9.9182 8.68456 10.3106 13.8513 7.30758 18.0293 16.4201 8.73515 12.1551 numMergedOcc 0
41 mol 292 unq 2 iso 0 dist 9.454 9.9182 8.68456 12.1693 14.0515 9.10788 9.98079 15.6736 9.08193 10.0311 numMergedOcc 0
42 mol 292 unq 3 iso 0 dist 9.454 9.9182 8.68456 12.1693 14.0515 9.10788 18.0293 16.4201 8.73515 10.8709 numMergedOcc 0
