0 mol 1 unq 0 iso 0 dist 7.81034 6.4181 4.58277 4.93091 9.21329 10.1151 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19497 6.4181 9.98089 4.93091 8.54277 10.1151 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 6.47123 5.5745 4.92096 4.00237 8.3726 6.90295 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.67455 9.7522 5.71065 3.30063 6.70325 7.98005 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.00234 8.91902 4.33228 8.04676 9.87102 9.28702 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 7.30652 5.47319 7.0643 14.2223 9.87102 16.3466 numMergedOcc 0
6 mol 69 unq 2 iso 0 dist 7.30652 9.8809 15.5982 14.2223 9.87102 23.8252 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.92491 7.47794 7.84269 13.3471 9.50939 14.6623 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 7.41861 6.4551 10.6009 9.68005 9.50939 10.985 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.87089 7.74197 14.8536 4.56066 5.60174 10.7263 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 8.87089 7.86537 16.4761 4.56066 5.60174 12.2051 numMergedOcc 0
11 mol 88 unq 2 iso 0 dist 8.87089 6.35462 7.86667 4.56066 5.60174 7.74064 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.29249 7.5819 9.40813 6.21004 9.62106 11.7686 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 8.3565 8.35636 6.66379 3.98588 9.87557 8.11702 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 6.9268 9.3894 10.2681 8.4707 8.98028 17.0809 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 8.65008 7.26897 11.181 11.9194 8.76245 15.5495 numMergedOcc 0
16 mol 157 unq 0 iso 0 dist 8.78412 6.1835 6.91388 6.11737 9.46735 8.10592 numMergedOcc 0
17 mol 159 unq 0 iso 0 dist 7.52779 4.91784 7.18851 10.3725 8.61788 13.3498 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 6.28957 8.43038 4.70374 3.92405 7.20131 6.83528 numMergedOcc 0
19 mol 167 unq 1 iso 0 dist 7.34285 9.87966 4.70374 6.18329 7.20131 6.83528 numMergedOcc 0
20 mol 167 unq 2 iso 0 dist 9.63473 8.14096 8.90206 3.86842 7.84707 9.86868 numMergedOcc 0
21 mol 169 unq 0 iso 0 dist 6.09291 9.46833 6.21354 4.24401 6.27378 11.4221 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 6.60418 8.1088 10.2688 11.5164 9.19939 18.3573 numMergedOcc 0
23 mol 185 unq 0 iso 0 dist 8.85182 9.878 6.99799 5.80135 9.44685 12.7881 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 5.05912 6.752 4.37383 9.4797 9.21286 12.5568 numMergedOcc 0
25 mol 205 unq 1 iso 0 dist 6.60429 8.10287 13.0749 13.314 9.21286 20.4235 numMergedOcc 0
26 mol 205 unq 2 iso 0 dist 6.60429 5.4913 4.37383 13.314 9.21286 12.5568 numMergedOcc 0
27 mol 265 unq 0 iso 0 dist 9.94957 9.772 17.2234 14.366 6.04835 22.4828 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 7.8547 9.09967 4.84546 11.1514 8.82003 12.4905 numMergedOcc 0
29 mol 274 unq 1 iso 0 dist 7.8547 8.49076 13.2618 11.1514 8.82003 19.1774 numMergedOcc 0
