0 mol 16 unq 0 iso 0 dist 9.15471 5.61445 9.30471 8.82587 6.88552 5.05803 11.7652 10.3757 7.03948 6.2983 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.65828 4.52042 9.80897 10.9309 12.8257 8.34347 10.7269 11.1917 6.73162 7.23546 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 7.67459 9.69698 8.03754 15.7652 14.0204 8.80331 16.4993 10.1053 9.83618 10.4442 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.67459 9.69698 8.03754 15.8918 13.1056 6.20293 16.4993 10.1053 9.83618 9.49077 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.45684 11.6779 8.75668 11.8671 7.26966 9.67592 10.4215 4.97497 8.68586 5.3948 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 7.76644 10.1207 8.75668 10.9973 7.26966 9.67592 11.8445 4.97497 8.68586 5.3948 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 7.93145 9.14798 6.96759 16.1633 13.8905 7.79912 7.49283 6.78257 5.15851 10.0425 numMergedOcc 0
7 mol 75 unq 1 iso 0 dist 7.93145 9.14798 6.96759 17.6145 12.899 8.56639 7.49283 6.78257 5.15851 11.8774 numMergedOcc 0
8 mol 75 unq 2 iso 0 dist 7.93145 9.14798 6.96759 15.3522 8.41332 8.59017 7.49283 6.78257 5.15851 10.0372 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 5.92836 14.5299 9.47554 10.1767 5.34829 7.11802 12.3358 6.61857 7.92688 4.68409 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 5.92836 14.5299 9.47554 11.6202 9.67676 8.00618 12.3358 6.61857 7.92688 12.2037 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.27341 9.50073 8.41774 15.3848 13.1435 8.56324 16.6251 10.8622 9.13561 5.99333 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 9.27341 9.50073 8.41774 16.0753 13.793 6.70283 16.6251 10.8622 9.13561 8.25411 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 9.27341 9.50073 8.41774 16.0158 11.2124 7.16148 16.6251 10.8622 9.13561 7.89109 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.23669 15.0515 9.44947 18.9597 10.5243 7.10633 19.5917 12.7783 5.90931 5.09262 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 9.23669 15.0515 9.44947 15.8109 10.2677 8.51516 19.5917 12.7783 5.90931 12.9483 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 8.8886 11.2558 9.62543 10.795 8.42394 7.56373 16.9282 12.5973 9.52027 6.43758 numMergedOcc 0
17 mol 209 unq 1 iso 0 dist 8.78565 12.9345 9.62543 14.4808 8.42394 7.56373 19.7639 12.5973 9.52027 6.43758 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 9.57625 13.0808 5.39218 20.4393 13.3213 9.23153 18.5237 9.46015 6.84247 6.7067 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 9.57625 13.0808 5.39218 20.4393 13.3213 9.23153 10.8781 4.51612 6.99002 15.9568 numMergedOcc 0
20 mol 220 unq 2 iso 0 dist 9.57625 13.0808 5.39218 20.5878 11.4842 8.24498 18.5237 9.46015 6.84247 6.05129 numMergedOcc 0
21 mol 220 unq 3 iso 0 dist 9.57625 13.0808 5.39218 20.5878 11.4842 8.24498 10.8781 4.51612 6.99002 11.1321 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.96263 11.9904 7.49783 10.9817 12.8561 8.95269 8.39753 4.76056 7.06793 9.36098 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 8.96263 11.9904 7.49783 10.9817 12.8561 8.95269 12.5544 10.7068 6.67585 5.29877 numMergedOcc 0
