0 mol 55 unq 0 iso 0 dist 6.73143 8.3038 3.98123 5.03701 6.13181 9.63353 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 4.35437 5.52904 4.67883 4.04916 7.51138 9.49744 numMergedOcc 0
2 mol 90 unq 1 iso 0 dist 4.35437 5.52904 4.67883 9.70636 9.86843 13.1387 numMergedOcc 0
3 mol 90 unq 2 iso 0 dist 4.35437 5.52904 4.67883 8.46448 6.86146 11.2433 numMergedOcc 0
4 mol 90 unq 3 iso 0 dist 4.35437 5.52904 4.67883 10.7717 8.83296 10.0174 numMergedOcc 0
5 mol 90 unq 4 iso 0 dist 4.85949 8.11993 5.30747 10.8479 8.83296 9.08732 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.49149 9.08322 11.48 4.42156 7.63127 10.4288 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 6.89591 5.55632 4.83835 13.5223 9.71408 14.3118 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 5.94881 8.00826 11.6193 6.75094 9.75627 14.1672 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 9.07517 9.28442 5.43768 10.9189 5.44396 10.3541 numMergedOcc 0
10 mol 193 unq 1 iso 0 dist 9.07517 9.28442 5.43768 7.05903 6.22972 7.06636 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 8.26119 9.3032 7.82899 9.55026 5.52678 5.13892 numMergedOcc 0
12 mol 194 unq 1 iso 0 dist 8.26119 9.3032 7.82899 5.81844 9.81666 8.2232 numMergedOcc 0
13 mol 194 unq 2 iso 0 dist 9.10338 8.10451 7.82899 7.42146 5.52678 5.13892 numMergedOcc 0
14 mol 194 unq 3 iso 0 dist 9.10338 8.10451 7.82899 14.7061 9.81666 8.2232 numMergedOcc 0
15 mol 194 unq 4 iso 0 dist 9.10338 6.6747 10.0237 7.42146 5.52678 5.78717 numMergedOcc 0
16 mol 194 unq 5 iso 0 dist 9.10338 6.6747 10.0237 14.7061 9.81666 10.3448 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 8.09112 7.22473 5.42399 7.60209 8.3149 11.0937 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 8.09112 6.02628 10.39 7.60209 8.3149 12.6218 numMergedOcc 0
19 mol 260 unq 2 iso 0 dist 5.6002 7.13397 5.42399 6.52502 8.3149 11.0937 numMergedOcc 0
20 mol 260 unq 3 iso 0 dist 5.6002 5.33278 9.79316 6.52502 8.3149 9.33382 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 8.43465 8.26228 8.89888 7.79077 5.74568 12.5209 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 9.51226 6.22003 9.3694 5.33371 4.95189 8.2659 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 9.66445 9.32126 14.0151 6.89875 7.41079 13.1177 numMergedOcc 0
24 mol 294 unq 1 iso 0 dist 9.66445 9.38111 17.6199 6.89875 7.41079 13.7418 numMergedOcc 0
25 mol 294 unq 2 iso 0 dist 9.66445 9.14005 11.9969 6.89875 7.41079 13.45 numMergedOcc 0
