0 mol 9 unq 0 iso 0 dist 8.77049 6.67398 7.2199 12.2544 5.80437 9.29529 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.95341 9.03359 7.2199 9.79973 5.80437 9.29529 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 8.7215 6.03855 6.50017 12.1665 11.3312 6.52726 numMergedOcc 0
3 mol 105 unq 1 iso 0 dist 8.7215 6.03855 6.50017 13.3791 5.27191 9.12363 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 7.50886 9.22317 9.86739 10.853 12.0339 9.49413 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 6.96057 9.24319 9.49413 12.8915 12.0339 9.86739 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.58063 10.3316 6.40036 13.7893 9.37623 7.99631 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.9344 6.2062 5.99299 15.1748 7.08159 9.94276 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 8.9344 6.2062 5.99299 13.8795 9.00907 9.05357 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 9.16944 5.10076 6.51096 13.3067 6.0706 8.73171 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 8.45395 7.58472 8.20656 5.41368 5.3528 9.40622 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 9.15368 4.24915 8.20656 7.96182 5.3528 9.40622 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 9.20477 5.70246 8.20656 7.90237 5.3528 9.40622 numMergedOcc 0
13 mol 181 unq 3 iso 0 dist 5.41368 7.58472 9.40622 8.45395 5.3528 8.20656 numMergedOcc 0
14 mol 181 unq 4 iso 0 dist 7.96182 4.24915 9.40622 9.15368 5.3528 8.20656 numMergedOcc 0
15 mol 181 unq 5 iso 0 dist 7.90237 5.70246 9.40622 9.20477 5.3528 8.20656 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 8.42382 7.51342 6.152 11.6985 8.55671 7.95168 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.46582 14.0686 6.5772 13.1095 5.44694 6.65088 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.46582 14.0686 6.5772 13.0803 6.32518 8.70193 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 9.46582 14.0686 6.5772 12.4083 9.50847 6.17025 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 9.46582 14.0686 6.5772 18.4963 14.4744 9.0378 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 7.77265 7.69259 9.1101 9.65322 8.07376 8.93338 numMergedOcc 0
22 mol 243 unq 1 iso 0 dist 9.65322 7.69259 8.93338 7.77265 8.07376 9.1101 numMergedOcc 0
23 mol 243 unq 2 iso 0 dist 6.9453 4.12468 8.93338 10.7436 8.07376 9.1101 numMergedOcc 0
24 mol 270 unq 0 iso 0 dist 8.76013 6.41275 8.39167 12.9688 7.61559 9.16073 numMergedOcc 0
25 mol 270 unq 1 iso 0 dist 8.76013 12.4967 9.17227 12.9688 7.61559 6.79822 numMergedOcc 0
26 mol 293 unq 0 iso 0 dist 9.95532 4.47568 6.33356 13.9322 4.6465 9.70656 numMergedOcc 0
