0 mol 34 unq 0 iso 0 dist 8.36524 9.05146 8.16494 4.81606 9.44189 7.19145 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 5.00932 8.99509 6.66818 8.92291 4.97991 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.06275 14.8755 8.47617 10.8481 6.79185 4.97991 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 8.90024 5.00932 8.47617 6.66818 6.79185 4.97991 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 6.78532 5.00932 5.73331 6.66818 8.37962 4.97991 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 9.9633 12.0707 8.93253 7.45267 6.78225 6.03696 numMergedOcc 0
6 mol 110 unq 1 iso 0 dist 7.77678 6.99654 8.1306 10.5289 6.2967 6.03696 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.94541 9.35663 8.75736 9.67406 8.65986 5.1707 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 8.94541 4.4033 6.76166 9.67406 8.65986 6.2148 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 7.30919 14.4662 8.75736 15.7575 8.65986 5.1707 numMergedOcc 0
10 mol 134 unq 3 iso 0 dist 7.30919 12.021 6.76166 15.7575 8.65986 6.2148 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.03426 5.71583 6.31556 5.49358 5.85698 5.67741 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.52413 15.6548 7.09426 11.6031 8.64379 9.12546 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 7.70631 10.0858 9.14737 15.4811 8.02386 11.8121 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 7.70631 10.0858 9.14737 7.35039 6.6259 5.18119 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 9.73691 9.92307 8.48081 13.8211 8.96646 14.5443 numMergedOcc 0
16 mol 213 unq 1 iso 0 dist 9.73691 9.92307 8.48081 14.9053 7.2016 15.4318 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 7.6664 10.8459 7.0935 8.025 7.55134 4.43802 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 7.43241 15.2838 9.12551 11.0973 8.06073 6.3943 numMergedOcc 0
