0 mol 71 unq 0 iso 0 dist 7.92957 9.95096 12.3881 7.79997 7.69793 10.494 numMergedOcc 0
1 mol 71 unq 1 iso 0 dist 7.92957 9.95096 12.3881 8.5293 6.734 6.28521 numMergedOcc 0
2 mol 71 unq 2 iso 0 dist 7.92957 9.95096 12.3881 8.54194 9.29164 7.82416 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 8.73544 5.11612 6.37222 9.36283 6.6796 6.34759 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 6.25968 8.75736 12.0992 6.77398 11.0076 5.45435 numMergedOcc 0
5 mol 134 unq 1 iso 0 dist 6.25968 8.75736 12.0992 5.68207 5.54305 10.302 numMergedOcc 0
6 mol 134 unq 2 iso 0 dist 6.25968 6.32178 4.8408 6.77398 11.0076 8.47569 numMergedOcc 0
7 mol 134 unq 3 iso 0 dist 6.25968 6.32178 4.8408 5.68207 5.54305 5.99395 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.16949 6.40792 9.7827 7.59889 10.9472 4.90549 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 8.65294 6.40792 5.80354 7.59889 8.08387 4.90549 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 9.89646 9.23551 10.2089 7.9061 15.5988 8.59354 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 9.89646 9.23551 10.2089 4.48898 10.9183 8.54341 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.07154 9.37459 14.5814 9.65224 11.5347 9.73393 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 9.07154 9.0847 16.8649 9.65224 11.5347 12.8308 numMergedOcc 0
14 mol 152 unq 2 iso 0 dist 9.07154 6.00061 12.692 9.65224 11.5347 6.56944 numMergedOcc 0
15 mol 152 unq 3 iso 0 dist 9.07154 8.33302 15.1967 9.65224 11.5347 8.08549 numMergedOcc 0
16 mol 174 unq 0 iso 0 dist 8.36618 6.90813 4.69892 8.79469 5.2323 8.37744 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 5.89811 7.86668 5.4508 6.94875 6.86988 11.9386 numMergedOcc 0
18 mol 267 unq 0 iso 0 dist 9.70756 6.19138 5.09878 9.18446 11.1259 6.45566 numMergedOcc 0
19 mol 267 unq 1 iso 0 dist 7.21009 6.54381 7.22349 6.60591 4.62072 6.45566 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 9.79817 5.59626 11.4271 7.10608 13.5709 6.24406 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 9.79817 5.59626 11.4271 7.22993 8.62293 9.58484 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 9.44726 7.11081 4.81126 8.66938 16.4188 12.1551 numMergedOcc 0
