0 mol 79 unq 0 iso 0 dist 7.74131 5.55798 4.20398 7.06029 6.82396 4.13187 4.95654 11.4057 7.82966 8.75375 numMergedOcc 0
1 mol 79 unq 1 iso 0 dist 7.74131 5.55798 4.20398 7.06029 6.82396 4.13187 10.0025 12.2455 8.26763 9.04293 numMergedOcc 0
2 mol 79 unq 2 iso 0 dist 7.74131 5.55798 4.20398 7.06029 6.82396 4.13187 6.35003 10.2188 6.30814 4.78333 numMergedOcc 0
3 mol 79 unq 3 iso 0 dist 7.74131 5.55798 4.20398 7.06029 6.82396 4.13187 3.45432 7.58743 7.318 9.18411 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 8.06034 5.81553 5.73618 9.60648 3.37479 7.8359 3.82552 9.26141 6.6536 9.66492 numMergedOcc 0
5 mol 168 unq 0 iso 0 dist 9.76722 5.60956 4.65845 6.48066 7.13766 3.60864 9.43003 9.23064 8.18217 7.0961 numMergedOcc 0
6 mol 168 unq 1 iso 0 dist 9.76722 5.60956 4.65845 6.48066 7.13766 3.60864 8.01699 7.30338 5.51167 8.21227 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 8.44483 6.09291 11.8115 7.50458 3.69097 10.1931 6.22697 10.7469 7.06772 7.65903 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 8.44483 6.09291 11.8115 5.79554 7.14832 10.5136 6.22697 10.7469 7.06772 5.97653 numMergedOcc 0
9 mol 169 unq 2 iso 0 dist 8.44483 6.09291 11.8115 4.22003 8.01356 10.212 6.22697 10.7469 7.06772 7.75523 numMergedOcc 0
10 mol 169 unq 3 iso 0 dist 9.79864 6.09291 12.8928 7.50458 11.5623 10.1931 6.22697 15.4495 7.06772 7.65903 numMergedOcc 0
11 mol 169 unq 4 iso 0 dist 9.79864 6.09291 12.8928 5.79554 12.6041 10.5136 6.22697 15.4495 7.06772 5.97653 numMergedOcc 0
12 mol 169 unq 5 iso 0 dist 9.79864 6.09291 12.8928 4.22003 10.4049 10.212 6.22697 15.4495 7.06772 7.75523 numMergedOcc 0
13 mol 169 unq 6 iso 0 dist 9.73241 6.09291 11.3409 7.50458 16.721 10.1931 6.22697 15.034 7.06772 7.65903 numMergedOcc 0
14 mol 169 unq 7 iso 0 dist 9.73241 6.09291 11.3409 5.79554 14.8989 10.5136 6.22697 15.034 7.06772 5.97653 numMergedOcc 0
15 mol 169 unq 8 iso 0 dist 9.73241 6.09291 11.3409 4.22003 11.6433 10.212 6.22697 15.034 7.06772 7.75523 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 9.80584 5.21088 8.61606 5.05414 9.70184 3.9335 3.81315 10.8599 7.75405 8.7652 numMergedOcc 0
17 mol 192 unq 1 iso 0 dist 9.80584 5.21088 8.61606 7.16964 13.6636 5.31881 3.81315 10.8599 7.75405 10.0838 numMergedOcc 0
18 mol 192 unq 2 iso 0 dist 9.80584 8.25609 4.97164 5.05414 9.70184 10.6087 3.81315 10.8599 7.49971 8.7652 numMergedOcc 0
19 mol 192 unq 3 iso 0 dist 9.80584 8.25609 4.97164 5.05414 9.70184 10.6087 9.53633 11.9648 9.07427 13.4673 numMergedOcc 0
20 mol 192 unq 4 iso 0 dist 9.80584 8.25609 4.97164 7.16964 13.6636 13.6786 3.81315 10.8599 7.49971 10.0838 numMergedOcc 0
21 mol 192 unq 5 iso 0 dist 9.80584 8.25609 4.97164 7.16964 13.6636 13.6786 9.53633 11.9648 9.07427 16.6697 numMergedOcc 0
22 mol 192 unq 6 iso 0 dist 7.95713 5.21088 5.41356 5.05414 8.12818 3.9335 3.81315 8.8637 7.75405 8.7652 numMergedOcc 0
23 mol 192 unq 7 iso 0 dist 7.95713 5.21088 5.41356 7.16964 10.7274 5.31881 3.81315 8.8637 7.75405 10.0838 numMergedOcc 0
24 mol 192 unq 8 iso 0 dist 7.95713 8.25609 4.87986 5.05414 8.12818 10.6087 3.81315 8.8637 7.49971 8.7652 numMergedOcc 0
25 mol 192 unq 9 iso 0 dist 7.95713 8.25609 4.87986 5.05414 8.12818 10.6087 9.53633 12.9151 9.07427 13.4673 numMergedOcc 0
26 mol 192 unq 10 iso 0 dist 7.95713 8.25609 4.87986 7.16964 10.7274 13.6786 3.81315 8.8637 7.49971 10.0838 numMergedOcc 0
27 mol 192 unq 11 iso 0 dist 7.95713 8.25609 4.87986 7.16964 10.7274 13.6786 9.53633 12.9151 9.07427 16.6697 numMergedOcc 0
28 mol 233 unq 0 iso 0 dist 7.74693 9.44671 11.8011 9.69772 9.30391 7.82473 13.5179 18.8438 8.93995 16.0169 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 8.36393 5.90728 4.01355 9.35302 15.5185 12.6455 5.14231 7.81241 5.32876 13.6064 numMergedOcc 0
30 mol 283 unq 1 iso 0 dist 8.36393 5.90728 4.01355 9.35302 15.5185 12.6455 4.25884 9.52445 7.60296 13.0176 numMergedOcc 0
31 mol 283 unq 2 iso 0 dist 8.36393 5.90728 4.01355 8.85163 6.35533 7.97597 5.14231 7.81241 5.32876 11.5443 numMergedOcc 0
32 mol 283 unq 3 iso 0 dist 8.36393 5.90728 4.01355 8.85163 6.35533 7.97597 4.25884 9.52445 7.60296 11.6249 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 11.9352 10.5491 8.43856 15.192 numMergedOcc 0
34 mol 288 unq 0 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 11.9352 10.5491 8.43856 15.192 numMergedOcc 0
35 mol 289 unq 0 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 11.9352 10.5491 8.43856 15.192 numMergedOcc 0
