0 mol 69 unq 0 iso 0 dist 8.24121 8.52371 10.149 7.48749 9.74996 8.21667 numMergedOcc 0
1 mol 69 unq 1 iso 0 dist 8.24121 6.8198 12.0119 7.48749 9.74996 13.047 numMergedOcc 0
2 mol 69 unq 2 iso 0 dist 8.52371 8.24121 10.149 7.48749 8.21667 9.74996 numMergedOcc 0
3 mol 69 unq 3 iso 0 dist 8.52371 6.8198 9.16015 7.48749 8.21667 13.047 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 9.1329 9.33217 10.5639 6.69874 8.50159 13.3168 numMergedOcc 0
5 mol 87 unq 1 iso 0 dist 9.1329 9.03114 7.40574 6.69874 8.50159 12.4093 numMergedOcc 0
6 mol 87 unq 2 iso 0 dist 5.26938 8.91602 7.40574 3.66319 8.50159 12.4093 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 7.48277 9.0361 9.15076 5.51997 9.43411 9.80678 numMergedOcc 0
8 mol 102 unq 1 iso 0 dist 9.0361 7.48277 9.15076 11.7098 9.01767 12.9236 numMergedOcc 0
9 mol 102 unq 2 iso 0 dist 9.0361 7.48277 9.15076 5.51997 9.80678 9.43411 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 8.93552 8.35604 10.2788 11.6665 6.86946 16.2389 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 6.20658 7.83568 10.2788 9.9398 6.86946 16.2389 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 8.62711 6.65963 7.30196 15.8417 8.40046 12.4824 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 5.44596 9.41832 6.43459 8.91817 9.93572 11.7961 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 5.44596 9.69069 9.87462 8.91817 9.93572 16.9576 numMergedOcc 0
15 mol 162 unq 0 iso 0 dist 9.89142 8.06091 10.4637 9.75316 9.82249 14.8915 numMergedOcc 0
16 mol 185 unq 0 iso 0 dist 9.03315 9.59096 13.2477 4.81985 8.04591 11.9545 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 7.30244 7.29796 6.89336 11.8854 8.48112 14.9294 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 7.34316 9.94212 12.3422 6.5658 7.82697 12.0329 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 9.12305 9.30906 5.46301 8.83586 8.49299 10.7576 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.67877 8.81059 17.2075 9.0655 5.73296 17.0459 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 9.67877 9.12006 18.4031 9.0655 5.73296 18.0882 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 7.15785 9.43169 5.51688 6.13416 9.62828 13.3636 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 4.78812 6.62923 5.40809 8.20642 6.94346 11.7245 numMergedOcc 0
24 mol 272 unq 1 iso 0 dist 6.62923 4.78812 5.40809 6.07797 9.1118 10.342 numMergedOcc 0
25 mol 276 unq 0 iso 0 dist 8.28881 5.30976 8.56707 4.48428 7.70061 9.05218 numMergedOcc 0
26 mol 276 unq 1 iso 0 dist 5.30976 8.28881 8.56707 4.48428 9.05218 7.70061 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 7.2795 9.41428 5.87439 6.69796 8.27793 10.8451 numMergedOcc 0
28 mol 284 unq 1 iso 0 dist 7.35866 7.32482 5.87439 5.09231 8.27793 10.8451 numMergedOcc 0
