0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 14.6665 7.10621 11.2706 16.6461 9.67164 8.75346 13.156 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.91301 11.375 6.4754 8.25051 9.62879 7.06064 13.8883 9.01112 4.67793 7.12261 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.91301 3.69663 6.57999 8.25051 9.62879 7.35767 13.8883 9.01112 11.5556 7.12261 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.11056 8.95357 8.20058 10.4744 8.86116 16.6906 6.40447 8.09311 12.0268 11.6226 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.11056 8.95357 8.20058 10.4744 8.86116 16.6906 3.96014 9.05357 9.10781 13.1949 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.11056 8.95357 8.20058 6.9756 8.38394 14.9411 6.40447 8.09311 12.0268 6.17155 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.11056 8.95357 8.20058 6.9756 8.38394 14.9411 3.96014 9.05357 9.10781 10.3122 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 7.20538 8.39913 8.96238 6.93876 8.66265 7.43826 7.2452 9.03564 12.9131 6.75591 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.18305 12.2435 8.124 4.69583 6.19304 13.4367 4.21749 8.68662 15.7072 6.20232 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.18305 12.2435 8.124 4.69583 6.19304 13.4367 5.65986 7.4369 15.2252 5.70116 numMergedOcc 0
10 mol 86 unq 0 iso 0 dist 8.88225 11.0165 8.40609 8.73453 9.5497 9.54732 6.62266 7.90423 4.74546 6.98209 numMergedOcc 0
11 mol 86 unq 1 iso 0 dist 9.49308 6.06198 8.40609 10.7693 9.5497 9.54732 3.88769 7.90423 4.74546 6.98209 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.3164 7.12319 8.84523 11.5656 8.69985 14.7654 8.08642 7.07971 10.5361 4.69373 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 8.89481 4.57112 9.08014 4.36935 5.86073 7.41343 7.09333 8.80934 9.3549 5.70579 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 5.63005 11.5865 8.62648 10.5268 8.73993 4.6251 5.92411 7.64052 12.6962 9.68677 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.60411 13.5049 7.27598 10.5108 6.37586 6.50005 11.6349 9.33924 4.70162 6.95573 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 9.60411 13.5049 7.27598 10.5108 6.37586 6.50005 3.76211 7.93372 12.487 8.06642 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 9.60411 13.5049 7.27598 6.20443 9.71307 12.0971 11.6349 9.33924 4.70162 10.2026 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 9.60411 13.5049 7.27598 6.20443 9.71307 12.0971 3.76211 7.93372 12.487 4.00092 numMergedOcc 0
