0 mol 1 unq 0 iso 0 dist 9.33719 7.16224 5.74199 9.34725 10.4572 8.69605 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 8.85401 5.48423 8.17981 11.8589 5.59667 8.31647 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.37509 4.11115 9.00925 11.382 16.2669 8.68949 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.5442 5.19187 9.27331 8.50028 4.68175 7.45777 numMergedOcc 0
4 mol 99 unq 0 iso 0 dist 6.24473 4.73115 6.81741 5.57391 4.74328 8.68674 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 9.0807 5.56761 7.81042 7.68908 8.96379 8.078 numMergedOcc 0
6 mol 103 unq 1 iso 0 dist 9.0807 5.56761 7.81042 10.7434 5.73608 6.56481 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 9.7097 6.40933 8.15549 14.6132 10.8474 9.39389 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 4.84604 6.92975 9.07294 6.29879 5.35551 5.79195 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 4.84604 6.53637 7.50126 6.29879 5.35551 9.2759 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 9.91507 4.92832 5.33543 9.67331 10.6104 9.88178 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 8.63766 16.8544 9.71692 17.4866 11.8278 9.18753 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 8.7107 16.9387 9.73708 17.4663 11.6537 9.15244 numMergedOcc 0
13 mol 165 unq 0 iso 0 dist 8.7717 16.3096 8.2197 16.916 10.5947 7.21397 numMergedOcc 0
14 mol 165 unq 1 iso 0 dist 8.10412 12.9431 8.2197 17.9247 10.5947 7.21397 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.87789 6.94426 7.02662 10.9616 6.12748 6.72718 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 9.87789 6.94426 7.02662 14.4183 8.01622 8.72949 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.87835 8.57997 6.41444 15.1447 7.48216 8.05949 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 9.54076 5.87078 6.41444 6.61789 7.48216 8.05949 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.03223 4.36623 7.35148 10.4047 11.4142 6.39087 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 7.73616 6.0185 5.97988 12.6687 10.0093 8.81063 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 9.29519 5.84124 7.20862 12.6646 12.3908 8.74399 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 8.99792 7.14491 9.174 13.6984 10.9643 7.26758 numMergedOcc 0
23 mol 244 unq 0 iso 0 dist 6.59726 9.27415 6.51428 10.4366 4.69664 7.43391 numMergedOcc 0
24 mol 244 unq 1 iso 0 dist 6.59726 9.27415 6.51428 17.0331 13.4155 7.79787 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 6.075 7.71145 5.76337 13.1166 7.87494 9.77023 numMergedOcc 0
26 mol 294 unq 1 iso 0 dist 5.27696 7.71145 9.39625 13.1166 11.4878 9.77023 numMergedOcc 0
