0 mol 9 unq 0 iso 0 dist 9.99657 14.634 8.59513 16.8758 13.0985 7.84963 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.78754 9.26728 9.81983 15.9527 9.36527 9.07476 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.2746 15.8916 8.21895 15.5808 7.46975 6.35779 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.7913 14.5986 6.89071 10.1965 4.00884 5.48163 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 7.7913 14.5986 6.89071 9.59503 4.1125 7.7399 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 5.59552 13.0919 9.69694 19.5733 15.7834 8.14427 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 5.37302 3.77247 5.35711 9.64281 9.01097 9.86767 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 8.03783 7.4003 5.35711 16.285 9.01097 9.86767 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 8.47541 7.80142 5.35711 13.9688 9.01097 9.86767 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.4733 3.80816 6.21165 11.3476 12.2067 8.42225 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 8.90876 7.13766 6.12453 9.76722 6.62718 6.48066 numMergedOcc 0
11 mol 168 unq 1 iso 0 dist 8.90876 7.29489 9.87447 13.3994 16.5533 8.47543 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 5.51388 3.89732 5.41121 9.83308 9.12553 9.58901 numMergedOcc 0
13 mol 169 unq 1 iso 0 dist 5.51388 7.16323 6.35799 14.1142 10.711 7.50458 numMergedOcc 0
14 mol 169 unq 2 iso 0 dist 8.17917 7.68348 5.41121 16.4114 9.12553 9.58901 numMergedOcc 0
15 mol 169 unq 3 iso 0 dist 8.17917 3.69097 6.35799 8.44483 10.711 7.50458 numMergedOcc 0
16 mol 169 unq 4 iso 0 dist 7.79437 4.24401 9.84538 8.44483 15.222 7.78577 numMergedOcc 0
17 mol 169 unq 5 iso 0 dist 8.68909 7.61664 5.41121 13.7475 9.12553 9.58901 numMergedOcc 0
18 mol 169 unq 6 iso 0 dist 8.68909 10.1079 6.35799 12.3476 10.711 7.50458 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 5.66363 3.55808 9.20617 5.75545 5.18154 8.17301 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 5.97968 6.33098 9.20617 8.86645 5.18154 8.17301 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 8.50382 12.4553 9.20617 13.2186 5.18154 8.17301 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 8.63119 8.9845 9.20617 11.1461 5.18154 8.17301 numMergedOcc 0
23 mol 188 unq 0 iso 0 dist 9.37017 11.2153 8.4784 15.3819 12.1341 8.85223 numMergedOcc 0
24 mol 244 unq 0 iso 0 dist 8.08939 3.62882 6.10489 5.06669 4.38246 5.16859 numMergedOcc 0
25 mol 244 unq 1 iso 0 dist 8.08939 7.8506 4.4204 5.06669 4.38246 4.79207 numMergedOcc 0
26 mol 244 unq 2 iso 0 dist 7.33574 5.2503 6.10489 5.65248 4.38246 5.16859 numMergedOcc 0
27 mol 244 unq 3 iso 0 dist 7.33574 3.66626 4.4204 5.65248 4.38246 4.79207 numMergedOcc 0
28 mol 286 unq 0 iso 0 dist 8.23877 9.30848 9.21276 5.03123 4.08297 8.87916 numMergedOcc 0
