0 mol 7 unq 0 iso 0 dist 7.11539 15.5773 9.97624 9.49158 8.60435 17.4118 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.1113 9.34692 8.19695 4.87491 7.46208 8.18566 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.50475 9.78889 7.34031 10.8275 7.59316 10.2706 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.66163 5.52962 7.34031 11.4765 7.59316 10.2706 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 9.48288 10.1477 7.34031 15.0853 7.59316 10.2706 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 7.1796 5.20585 7.281 11.309 7.51285 10.3548 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 7.1796 5.20585 7.281 6.08398 8.86698 10.9405 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 9.16212 9.98618 7.281 15.0743 7.51285 10.3548 numMergedOcc 0
8 mol 48 unq 6 iso 0 dist 9.16212 9.98618 7.281 5.11472 8.86698 10.9405 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.3387 10.8026 8.10446 5.8562 8.39326 7.64686 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.3387 10.8026 8.10446 7.08619 6.33741 7.59218 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 6.09256 5.03194 5.03173 10.7812 7.09806 6.14305 numMergedOcc 0
12 mol 105 unq 1 iso 0 dist 8.40598 6.10266 5.03173 6.50376 7.09806 6.14305 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 8.55826 18.0914 9.83981 14.5505 9.35942 8.36453 numMergedOcc 0
14 mol 114 unq 1 iso 0 dist 8.55826 18.0914 9.83981 4.43177 7.42482 17.1979 numMergedOcc 0
15 mol 114 unq 2 iso 0 dist 8.55826 13.7458 6.13559 14.5505 9.35942 6.22315 numMergedOcc 0
16 mol 114 unq 3 iso 0 dist 8.55826 13.7458 6.13559 4.43177 7.42482 13.0539 numMergedOcc 0
17 mol 114 unq 4 iso 0 dist 8.55826 8.67095 6.51395 14.5505 9.35942 6.18257 numMergedOcc 0
18 mol 114 unq 5 iso 0 dist 8.55826 8.67095 6.51395 4.43177 7.42482 10.4498 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 7.7461 8.88349 6.90634 15.4306 8.91311 9.52351 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 8.81111 15.0866 7.31037 4.88633 6.73983 11.1956 numMergedOcc 0
21 mol 141 unq 1 iso 0 dist 8.81111 15.0866 7.31037 9.46307 8.6387 9.65952 numMergedOcc 0
22 mol 158 unq 0 iso 0 dist 6.69487 6.66039 9.6096 4.88673 5.8628 10.6936 numMergedOcc 0
23 mol 173 unq 0 iso 0 dist 8.14167 13.5257 6.64779 6.35871 8.03528 10.2821 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 9.46558 4.83701 5.98039 10.3592 6.07878 9.38038 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 9.18477 12.2233 7.12785 9.8051 7.44706 8.16841 numMergedOcc 0
26 mol 243 unq 1 iso 0 dist 9.18477 4.54892 6.66959 9.8051 7.44706 6.03041 numMergedOcc 0
27 mol 250 unq 0 iso 0 dist 5.92578 4.82553 6.28538 4.67276 5.93798 7.62569 numMergedOcc 0
28 mol 265 unq 0 iso 0 dist 9.68583 9.72334 5.40318 8.06612 8.85062 7.10449 numMergedOcc 0
