0 mol 25 unq 0 iso 0 dist 8.46842 16.8735 9.48085 17.4161 10.9391 9.49421 22.1719 16.357 11.7199 6.6492 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.28058 10.8484 5.61588 13.3369 8.07446 5.5087 11.8984 5.16364 5.50891 8.85586 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 7.28058 10.8484 5.61588 13.3369 8.07446 5.5087 17.9373 11.2874 7.50869 7.11 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 7.28058 14.7963 7.83244 13.3369 8.07446 6.08682 11.8984 5.16364 4.75954 8.85586 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 7.28058 14.7963 7.83244 13.3369 8.07446 6.08682 17.9373 11.2874 3.6807 7.11 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 9.13413 11.7536 8.47988 11.6374 4.8896 9.02706 5.56098 6.47042 8.90959 6.78038 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.13413 5.8662 8.0427 11.6374 4.8896 9.39168 5.56098 6.47042 4.4941 6.78038 numMergedOcc 0
7 mol 218 unq 0 iso 0 dist 9.95084 13.8104 7.33709 14.328 4.72474 8.75536 12.0325 5.76954 6.57708 6.29367 numMergedOcc 0
8 mol 218 unq 1 iso 0 dist 9.95084 13.8104 7.33709 14.328 4.72474 8.75536 9.24887 6.29511 13.4147 8.86175 numMergedOcc 0
9 mol 218 unq 2 iso 0 dist 9.95084 13.8104 7.33709 14.4283 5.61978 6.67404 12.0325 5.76954 6.57708 9.20961 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 9.30186 6.38826 8.1945 12.2976 13.3965 6.50998 11.8955 11.5332 6.35462 6.6561 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 9.68636 9.76444 7.27993 11.9461 7.0298 6.95201 7.82856 8.92743 6.93188 5.77318 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.09166 17.7087 9.08509 17.3543 10.1813 6.99888 19.145 11.9624 5.63944 5.52379 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 9.13483 6.16483 6.34915 6.44188 5.74182 7.81897 7.39014 10.8431 5.96144 9.69696 numMergedOcc 0
14 mol 257 unq 1 iso 0 dist 5.16581 5.48725 6.34915 5.13633 5.74182 7.81897 9.87316 10.8431 5.96144 9.69696 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 14.0886 9.98105 6.9899 9.80192 8.55558 7.32929 8.59697 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 6.66602 12.6107 9.58916 13.6132 8.96144 5.90924 7.02897 6.42588 7.36132 7.52281 numMergedOcc 0
17 mol 264 unq 1 iso 0 dist 8.43682 4.66338 9.19754 6.20796 4.92077 8.29262 7.79077 6.04162 5.82131 6.14323 numMergedOcc 0
18 mol 264 unq 2 iso 0 dist 6.20796 4.66338 8.29262 8.43682 4.92077 9.19754 7.79077 6.14323 5.82131 6.04162 numMergedOcc 0
19 mol 264 unq 3 iso 0 dist 7.73693 10.3972 8.29262 10.6405 4.92077 9.19754 12.3382 6.14323 5.82131 6.04162 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 6.86014 14.6762 8.9682 18.2066 11.8268 9.57499 18.0971 12.7237 14.6871 6.57903 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 5.97073 11.3103 8.9682 12.8364 11.8268 9.57499 12.7639 12.7237 14.6871 6.57903 numMergedOcc 0
22 mol 277 unq 2 iso 0 dist 8.23147 6.40883 5.46926 10.0577 7.69449 9.57499 12.7322 11.5506 14.6871 6.57903 numMergedOcc 0
23 mol 277 unq 3 iso 0 dist 6.49176 6.40883 8.9682 10.0577 11.8268 9.57499 12.7322 12.7237 14.6871 6.57903 numMergedOcc 0
24 mol 277 unq 4 iso 0 dist 8.20217 6.68571 5.46926 5.22392 7.69449 9.57499 10.6266 11.5506 14.6871 6.57903 numMergedOcc 0
