0 mol 8 unq 0 iso 0 dist 9.91301 8.25051 9.62879 7.46102 8.4069 8.96553 12.3138 10.6335 7.43529 7.3915 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.36377 5.48395 6.31718 12.9591 10.8455 7.63133 15.6662 15.6697 10.454 6.56335 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.38387 11.8286 6.20293 13.3732 5.06502 5.73819 15.4696 10.0649 5.48048 8.44903 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 11.0671 5.4148 9.96396 11.4574 8.73253 8.26458 7.04044 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 13.2599 13.3558 8.70481 19.385 18.0011 14.8866 8.85586 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 6.18305 4.69583 6.19304 13.2599 13.3558 8.70481 11.9652 12.0613 8.05119 7.11 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 13.3494 11.5723 7.88312 8.59786 10.0289 7.21418 5.74857 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 7.81337 11.4498 6.85062 15.7871 10.7062 8.40312 13.611 11.6142 5.89022 8.86329 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 7.81337 11.4498 6.85062 10.4432 6.63273 7.12972 13.611 11.6142 5.89022 8.71039 numMergedOcc 0
9 mol 131 unq 2 iso 0 dist 7.81337 11.4498 6.85062 10.4432 6.63273 7.12972 6.99491 9.29384 9.32969 6.92648 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 5.86531 9.73435 8.00618 15.5083 11.965 6.29155 12.8565 10.5656 5.74088 6.76699 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 14.0674 8.80819 6.49416 18.0248 13.9396 8.46636 5.53031 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 9.60411 10.5108 6.37586 9.92932 5.49782 8.94367 8.2282 10.873 9.4027 8.20836 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 9.60411 10.5108 6.37586 14.0674 5.00817 6.49416 18.0248 10.1537 8.46636 5.53031 numMergedOcc 0
14 mol 134 unq 3 iso 0 dist 9.60411 6.20443 9.71307 9.92932 5.49782 9.86662 8.2282 10.873 5.12325 8.20836 numMergedOcc 0
15 mol 134 unq 4 iso 0 dist 9.55556 11.9294 8.94367 16.0579 8.80819 6.49416 20.0472 13.9396 8.46636 5.53031 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.07256 11.1874 6.70283 13.1529 5.42328 5.87555 15.2644 10.4911 5.59336 8.35555 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 8.07256 8.36099 7.16148 13.1529 5.42328 8.87437 15.2644 10.4911 10.9728 8.35555 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 9.36079 13.6173 7.7366 14.4684 5.63422 9.774 20.8465 12.3357 9.9412 8.70977 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 7.42904 9.96254 7.7366 12.7047 5.63422 9.774 17.9226 12.3357 9.9412 8.70977 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 16.8257 12.2278 10.5813 8.03442 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 12.3151 5.88703 6.56247 6.83465 7.5366 5.63086 8.24186 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 7.86368 6.94762 6.7625 12.3151 5.88703 9.36357 6.83465 7.5366 5.6819 8.24186 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.90987 5.26654 8.03456 11.2664 7.28249 9.81562 10.4981 11.9847 7.22918 8.50331 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 8.90987 3.82437 6.84306 11.2664 7.28249 7.68742 10.4981 11.9847 9.05842 8.50331 numMergedOcc 0
25 mol 236 unq 2 iso 0 dist 8.90987 13.8124 9.99038 11.2664 7.28249 6.27581 10.4981 11.9847 7.00028 8.50331 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 8.06771 9.79538 7.88519 11.1503 6.96053 7.46176 8.4973 10.5803 5.60748 8.55558 numMergedOcc 0
27 mol 261 unq 0 iso 0 dist 8.65236 4.49913 9.14619 9.73983 7.00201 8.45658 3.67304 5.26434 6.04016 8.60026 numMergedOcc 0
28 mol 261 unq 1 iso 0 dist 9.73983 4.49913 8.45658 8.65236 7.00201 9.14619 3.67304 8.60026 6.04016 5.26434 numMergedOcc 0
29 mol 272 unq 0 iso 0 dist 9.96394 11.5918 8.33638 13.3211 5.40809 8.46116 13.4231 11.9971 13.5034 9.19033 numMergedOcc 0
