0 mol 6 unq 0 iso 0 dist 7.27315 8.15992 5.69098 4.59751 9.97675 11.5544 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 6.86465 8.85796 5.69098 12.6562 9.97675 11.5544 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.84065 9.31461 11.6611 4.36784 9.83409 13.2184 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.25054 5.96899 5.33236 6.1852 9.55978 8.92491 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 8.77833 8.66738 16.276 15.1315 8.70005 20.3072 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.73832 9.85386 8.50831 11.6727 7.02351 10.2907 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.73832 4.8983 11.3918 11.6727 7.02351 15.7329 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 8.08277 6.11101 5.80317 12.1856 9.68277 13.3992 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.46036 6.34669 7.81379 7.30364 4.85152 9.22123 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 4.84683 9.51771 11.0943 6.43211 9.61113 9.61193 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 4.84683 9.51771 11.0943 6.93587 7.59973 15.01 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 9.54174 7.50959 4.36262 11.9801 8.86071 9.35938 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 9.54174 7.50959 4.36262 15.7288 9.82087 10.8122 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 6.3314 5.24948 4.36262 5.42805 8.86071 9.35938 numMergedOcc 0
14 mol 120 unq 3 iso 0 dist 6.3314 5.24948 4.36262 5.97517 9.82087 10.8122 numMergedOcc 0
15 mol 120 unq 4 iso 0 dist 9.08232 5.24948 6.80219 7.49569 9.40544 10.8171 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 7.56704 7.75833 5.0614 4.1643 7.8034 6.94015 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 7.53667 8.09561 4.52353 6.78674 7.99446 11.4253 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 7.53667 8.09561 4.52353 5.79944 7.21636 8.78397 numMergedOcc 0
19 mol 152 unq 2 iso 0 dist 7.53667 9.07315 6.79695 6.78674 7.99446 12.4377 numMergedOcc 0
20 mol 152 unq 3 iso 0 dist 7.53667 9.07315 6.79695 5.79944 7.21636 12.3356 numMergedOcc 0
21 mol 157 unq 0 iso 0 dist 8.695 7.75542 10.0833 5.18621 8.21352 11.8741 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 9.49714 5.49212 8.87273 11.4045 5.42004 12.2808 numMergedOcc 0
23 mol 211 unq 1 iso 0 dist 9.49714 5.49212 8.87273 13.8833 7.73993 14.4407 numMergedOcc 0
24 mol 211 unq 2 iso 0 dist 9.49714 9.79135 13.3043 11.4045 5.42004 16.7922 numMergedOcc 0
25 mol 211 unq 3 iso 0 dist 9.49714 9.79135 13.3043 13.8833 7.73993 18.7612 numMergedOcc 0
26 mol 224 unq 0 iso 0 dist 8.32947 6.06793 8.88341 4.57948 9.59565 10.4461 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 5.04068 5.94328 4.2886 5.52381 8.34471 9.33223 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 9.52075 7.91978 4.2886 6.0296 8.34471 9.33223 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 8.04439 8.67957 12.2565 10.8706 9.94705 10.7971 numMergedOcc 0
30 mol 286 unq 0 iso 0 dist 9.92773 8.08382 11.1153 5.69037 8.30708 12.3731 numMergedOcc 0
31 mol 286 unq 1 iso 0 dist 9.92773 8.08382 11.1153 6.54635 8.9718 10.0194 numMergedOcc 0
