0 mol 41 unq 0 iso 0 dist 8.6783 13.653 8.19484 12.9999 5.91275 7.89705 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.61209 10.3681 8.37544 13.6283 6.56327 7.43154 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 5.7638 8.11218 8.37544 8.87369 6.56327 7.43154 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 8.55679 8.11218 4.92955 8.87369 6.40817 7.43154 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 8.57785 12.0751 8.96507 12.8503 5.54298 8.72552 numMergedOcc 0
5 mol 55 unq 4 iso 0 dist 7.03751 9.47026 8.96507 10.0388 5.54298 8.72552 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 8.54119 5.60142 5.9644 11.9172 11.2919 9.16658 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.04935 10.6431 5.69384 13.2324 6.05149 6.07578 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 6.79564 12.0156 9.7171 10.6107 4.36597 9.39702 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 8.98367 10.8853 6.17362 17.6152 11.4636 7.50206 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 8.54297 5.34549 9.85832 8.20389 5.18427 6.4028 numMergedOcc 0
11 mol 128 unq 2 iso 0 dist 9.35162 11.0542 6.4416 8.20389 3.93522 7.50206 numMergedOcc 0
12 mol 128 unq 3 iso 0 dist 9.35162 5.34549 7.49024 8.20389 3.93522 6.4028 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 8.87505 14.0139 7.39532 15.2818 7.43279 4.85559 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 8.87505 14.0139 7.39532 19.4305 10.9627 6.87562 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 9.99743 9.37181 5.36078 8.87968 7.46995 4.0037 numMergedOcc 0
16 mol 173 unq 1 iso 0 dist 7.76856 5.86572 5.76772 10.0088 4.52935 7.70692 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.6011 17.4337 9.47421 23.4046 14.9776 8.74308 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.86805 5.81384 9.39659 10.1544 5.57126 9.54884 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 6.86805 7.90451 8.25445 9.70632 6.31111 7.25797 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 6.86805 7.90451 8.25445 10.1544 5.57126 6.03938 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 5.49794 4.81143 5.63154 12.8575 13.1905 8.84798 numMergedOcc 0
