0 mol 36 unq 0 iso 0 dist 7.34019 7.11464 6.11846 6.1084 4.24251 8.96522 6.6055 8.76585 3.58776 10.5994 numMergedOcc 0
1 mol 36 unq 1 iso 0 dist 8.43828 7.11464 7.3917 6.1084 9.98403 8.96522 6.6055 8.91922 3.58776 10.5994 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.31319 6.19084 10.5906 9.72136 13.1434 5.8481 9.942 15.711 6.67753 3.7765 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 9.31319 6.19084 10.5906 9.72136 13.1434 5.8481 5.92771 7.13979 8.49258 13.4768 numMergedOcc 0
4 mol 46 unq 2 iso 0 dist 9.31319 6.19084 10.5906 4.61355 10.9054 4.07933 9.942 15.711 6.67753 9.44812 numMergedOcc 0
5 mol 46 unq 3 iso 0 dist 9.31319 6.19084 10.5906 4.61355 10.9054 4.07933 5.92771 7.13979 8.49258 6.08836 numMergedOcc 0
6 mol 46 unq 4 iso 0 dist 8.2513 6.19084 12.8683 9.72136 14.5035 5.8481 9.942 16.0486 6.67753 3.7765 numMergedOcc 0
7 mol 46 unq 5 iso 0 dist 8.2513 6.19084 12.8683 9.72136 14.5035 5.8481 5.92771 9.26597 8.49258 13.4768 numMergedOcc 0
8 mol 46 unq 6 iso 0 dist 8.2513 6.19084 12.8683 4.61355 12.3186 4.07933 9.942 16.0486 6.67753 9.44812 numMergedOcc 0
9 mol 46 unq 7 iso 0 dist 8.2513 6.19084 12.8683 4.61355 12.3186 4.07933 5.92771 9.26597 8.49258 6.08836 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 5.94478 9.61913 9.91049 9.43076 6.80028 5.32166 7.85115 8.02001 16.6049 14.3087 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 9.26057 9.47346 9.02568 6.70684 4.1335 7.17096 6.60464 6.21159 3.99394 3.3389 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 9.7168 9.92375 11.2659 9.8506 15.239 5.62734 7.91749 6.77599 11.5773 13.5156 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 7.38138 9.92375 4.99768 9.8506 8.68046 5.62734 7.91749 10.2375 11.5773 13.5156 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 8.1504 9.58371 7.49843 6.22696 4.63654 8.68377 4.80508 6.81208 11.8112 5.09517 numMergedOcc 0
15 mol 158 unq 1 iso 0 dist 8.1504 9.58371 7.49843 6.22696 4.63654 8.68377 4.88625 5.74997 10.454 6.2149 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 8.3035 8.07237 7.8472 8.9694 8.48942 3.91276 6.03628 4.15355 4.05067 5.22858 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.29203 8.03226 10.3871 9.97859 16.7443 13.8857 9.59909 8.71924 3.63257 14.95 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.62771 8.03226 6.54814 9.97859 13.1408 13.8857 9.59909 4.56594 3.63257 14.95 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.80166 8.03226 14.388 9.97859 10.4706 13.8857 9.59909 14.2741 3.63257 14.95 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.74312 4.13216 5.97664 8.08382 6.68639 5.39801 3.66473 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.74312 4.13216 5.97664 8.08382 6.68639 5.39801 3.66473 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.22576 9.52718 4.9628 7.74312 4.13216 5.97664 8.08382 6.68639 5.39801 3.66473 numMergedOcc 0
