0 mol 2 unq 0 iso 0 dist 8.54182 10.0503 5.42021 5.30945 9.39095 8.35692 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 8.54182 13.5914 9.15006 5.30945 9.39095 10.6458 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.05165 6.5214 6.72531 7.36979 8.572 3.44412 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.17977 5.74095 4.67917 10.5464 9.34271 5.96516 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 6.17977 9.53452 5.81747 10.5464 9.34271 7.53537 numMergedOcc 0
5 mol 59 unq 2 iso 0 dist 9.0756 6.00127 4.67917 6.17313 9.34271 5.96516 numMergedOcc 0
6 mol 59 unq 3 iso 0 dist 9.0756 8.67492 5.81747 6.17313 9.34271 7.53537 numMergedOcc 0
7 mol 59 unq 4 iso 0 dist 6.83083 6.36602 4.67917 6.53316 9.34271 5.96516 numMergedOcc 0
8 mol 59 unq 5 iso 0 dist 6.83083 3.98162 5.81747 6.53316 9.34271 7.53537 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 7.50417 10.928 9.46472 13.7086 8.03895 15.9532 numMergedOcc 0
10 mol 78 unq 1 iso 0 dist 7.50417 10.928 9.46472 10.9209 5.68873 14.6188 numMergedOcc 0
11 mol 78 unq 2 iso 0 dist 8.29369 8.86457 9.53794 12.7015 8.48827 17.4664 numMergedOcc 0
12 mol 78 unq 3 iso 0 dist 8.29369 8.86457 9.53794 12.9102 7.14048 16.6402 numMergedOcc 0
13 mol 78 unq 4 iso 0 dist 8.29369 7.59211 9.84346 12.7015 8.48827 15.9532 numMergedOcc 0
14 mol 78 unq 5 iso 0 dist 8.29369 7.59211 9.84346 12.9102 7.14048 14.6188 numMergedOcc 0
15 mol 78 unq 6 iso 0 dist 6.75455 10.6415 9.53794 11.1086 8.48827 17.4664 numMergedOcc 0
16 mol 78 unq 7 iso 0 dist 6.75455 10.6415 9.53794 10.2834 7.14048 16.6402 numMergedOcc 0
17 mol 78 unq 8 iso 0 dist 6.75455 5.13304 9.84346 11.1086 8.48827 15.9532 numMergedOcc 0
18 mol 78 unq 9 iso 0 dist 6.75455 5.13304 9.84346 10.2834 7.14048 14.6188 numMergedOcc 0
19 mol 78 unq 10 iso 0 dist 6.28063 5.13304 9.46472 11.1086 8.03895 15.9532 numMergedOcc 0
20 mol 78 unq 11 iso 0 dist 6.28063 5.13304 9.46472 10.2834 5.68873 14.6188 numMergedOcc 0
21 mol 81 unq 0 iso 0 dist 9.1024 4.79903 5.96486 3.71214 9.53663 5.82911 numMergedOcc 0
22 mol 112 unq 0 iso 0 dist 9.9065 16.0236 8.06034 16.0647 9.60648 3.37479 numMergedOcc 0
23 mol 120 unq 0 iso 0 dist 9.32214 8.42157 8.43293 9.9341 9.58434 6.03314 numMergedOcc 0
24 mol 120 unq 1 iso 0 dist 9.32214 8.42157 8.43293 12.4144 9.16089 4.74539 numMergedOcc 0
25 mol 120 unq 2 iso 0 dist 7.61244 6.80253 8.43293 4.03393 9.58434 6.03314 numMergedOcc 0
26 mol 120 unq 3 iso 0 dist 7.61244 6.80253 8.43293 8.26567 9.16089 4.74539 numMergedOcc 0
27 mol 163 unq 0 iso 0 dist 9.36038 12.1164 7.5447 12.9222 9.37245 15.4278 numMergedOcc 0
28 mol 163 unq 1 iso 0 dist 9.36038 18.4036 9.04757 12.9222 9.37245 13.5948 numMergedOcc 0
29 mol 169 unq 0 iso 0 dist 6.58221 11.3596 8.44483 11.2558 7.50458 3.69097 numMergedOcc 0
30 mol 169 unq 1 iso 0 dist 6.58221 11.3596 8.44483 7.06519 5.79554 7.14832 numMergedOcc 0
31 mol 169 unq 2 iso 0 dist 6.58221 11.3596 8.44483 3.7498 4.22003 8.01356 numMergedOcc 0
32 mol 169 unq 3 iso 0 dist 6.58221 11.6029 9.79864 11.2558 7.50458 11.5623 numMergedOcc 0
33 mol 169 unq 4 iso 0 dist 6.58221 11.6029 9.79864 7.06519 5.79554 12.6041 numMergedOcc 0
34 mol 169 unq 5 iso 0 dist 6.58221 11.6029 9.79864 3.7498 4.22003 10.4049 numMergedOcc 0
35 mol 169 unq 6 iso 0 dist 6.58221 10.4615 9.73241 11.2558 7.50458 16.721 numMergedOcc 0
36 mol 169 unq 7 iso 0 dist 6.58221 10.4615 9.73241 7.06519 5.79554 14.8989 numMergedOcc 0
37 mol 169 unq 8 iso 0 dist 6.58221 10.4615 9.73241 3.7498 4.22003 11.6433 numMergedOcc 0
38 mol 196 unq 0 iso 0 dist 6.21436 7.79586 8.86439 11.0495 9.34759 6.16315 numMergedOcc 0
39 mol 204 unq 0 iso 0 dist 8.26132 10.2123 9.91429 8.06206 8.49554 5.04761 numMergedOcc 0
40 mol 204 unq 1 iso 0 dist 8.82838 9.8571 9.91429 8.84143 8.49554 5.04761 numMergedOcc 0
41 mol 233 unq 0 iso 0 dist 8.69185 7.41379 7.74693 12.6841 9.69772 9.30391 numMergedOcc 0
42 mol 278 unq 0 iso 0 dist 8.31953 12.5979 9.60643 7.50969 9.93392 7.09039 numMergedOcc 0
43 mol 278 unq 1 iso 0 dist 8.31953 13.4866 7.79408 7.50969 9.93392 10.8254 numMergedOcc 0
44 mol 283 unq 0 iso 0 dist 5.33054 9.63141 8.36393 5.91899 9.35302 15.5185 numMergedOcc 0
45 mol 283 unq 1 iso 0 dist 5.33054 9.63141 8.36393 8.2722 8.85163 6.35533 numMergedOcc 0
46 mol 283 unq 2 iso 0 dist 8.56376 10.2512 8.36393 8.32685 9.35302 15.5185 numMergedOcc 0
47 mol 283 unq 3 iso 0 dist 8.56376 10.2512 8.36393 5.93642 8.85163 6.35533 numMergedOcc 0
48 mol 286 unq 0 iso 0 dist 7.6123 5.79125 5.03123 8.51361 8.87916 9.30848 numMergedOcc 0
49 mol 286 unq 1 iso 0 dist 7.6123 5.79125 5.03123 5.06709 8.27359 3.90927 numMergedOcc 0
50 mol 286 unq 2 iso 0 dist 7.6123 5.79125 5.03123 8.85788 8.14957 3.85003 numMergedOcc 0
