0 mol 0 unq 0 iso 0 dist 7.20999 13.6767 9.19007 11.0785 6.0225 6.94943 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 6.216 5.19655 7.64304 9.07013 3.89238 8.80146 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 7.15434 7.29541 5.72491 13.6482 7.12508 8.15894 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.20058 12.1567 6.72502 11.6434 5.11636 8.24948 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.51406 6.81213 5.69955 12.4917 8.25132 6.73167 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 7.51406 6.81213 5.69955 10.483 4.94205 7.40948 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 9.17086 8.33667 9.93832 13.0289 10.8828 7.24352 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 9.77018 7.79856 8.63486 5.91948 6.15355 5.07125 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 9.20523 7.80321 7.9814 12.5871 5.74372 9.45329 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.05602 14.9908 7.26086 9.55337 3.9764 8.75597 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.88255 6.89245 7.77116 6.88175 6.9194 9.6121 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 8.88255 6.89245 7.77116 14.8889 9.68677 9.57341 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 8.99949 14.8405 9.29384 19.8448 12.6005 6.78801 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 7.83582 11.3235 5.39064 12.2398 4.91618 7.19291 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 7.83582 11.3235 5.39064 11.2557 4.75859 6.66504 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 7.34465 7.97183 6.69515 13.7901 13.2918 6.77921 numMergedOcc 0
16 mol 141 unq 1 iso 0 dist 9.47675 7.97183 7.86572 13.7901 13.4066 6.77921 numMergedOcc 0
17 mol 159 unq 0 iso 0 dist 7.47975 9.78249 7.25742 11.27 4.48323 6.07821 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 7.13441 6.15895 5.10618 13.2972 13.9189 9.13027 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 8.3705 9.80071 7.62942 12.5713 6.04871 6.34234 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 8.3705 9.80071 7.62942 10.6913 8.04534 7.87972 numMergedOcc 0
21 mol 212 unq 0 iso 0 dist 9.47932 14.3725 6.29767 13.1493 3.9436 5.50658 numMergedOcc 0
22 mol 212 unq 1 iso 0 dist 9.47932 11.0448 8.74585 13.1493 3.9436 9.22129 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 8.7419 7.26742 7.862 11.2674 8.84507 7.97027 numMergedOcc 0
24 mol 222 unq 1 iso 0 dist 8.7419 7.26742 7.862 12.7466 8.67203 6.81955 numMergedOcc 0
25 mol 222 unq 2 iso 0 dist 8.7419 7.26742 7.862 10.656 6.02502 4.9876 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 9.60159 11.2986 8.38865 10.4038 4.1511 5.28771 numMergedOcc 0
27 mol 227 unq 1 iso 0 dist 7.71761 8.14937 5.87815 13.4351 5.73883 9.71916 numMergedOcc 0
28 mol 230 unq 0 iso 0 dist 5.62804 10.1088 6.41286 14.0318 9.70574 7.07833 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.38753 8.09178 5.52379 11.0533 4.48415 6.53286 numMergedOcc 0
30 mol 251 unq 0 iso 0 dist 7.54763 8.51564 8.01198 7.95984 4.86046 6.42747 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 6.8902 5.86656 6.14323 11.1879 13.2035 7.14086 numMergedOcc 0
32 mol 276 unq 0 iso 0 dist 8.54938 5.38576 7.88706 11.3123 9.33434 7.49391 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 7.58272 12.325 7.67245 20.2022 13.5923 8.63072 numMergedOcc 0
34 mol 278 unq 1 iso 0 dist 7.58272 12.325 7.67245 16.8764 10.0918 7.59696 numMergedOcc 0
