0 mol 8 unq 0 iso 0 dist 7.46102 7.96271 4.04644 8.25051 8.96553 12.1544 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.91301 7.96271 8.85986 8.25051 9.62879 12.1544 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 6.87018 8.97998 3.9467 5.45641 6.38364 10.0712 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.38387 9.52295 6.09486 11.0096 8.80331 14.1869 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.38387 9.52295 6.09486 11.8286 6.20293 9.07906 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.05508 8.11934 12.2118 5.34079 6.85766 12.7146 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 9.00229 8.11934 5.43926 10.1484 8.95999 12.2326 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 7.74197 6.64933 11.9839 4.0486 9.36773 9.54952 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 7.74197 8.67727 11.2929 4.0486 9.36773 11.4733 numMergedOcc 0
9 mol 88 unq 2 iso 0 dist 7.86537 6.64933 10.6664 4.0486 8.31336 9.54952 numMergedOcc 0
10 mol 88 unq 3 iso 0 dist 7.86537 8.67727 9.259 4.0486 8.31336 11.4733 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 6.18763 6.29634 7.36889 5.3154 6.18601 6.16081 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.44385 6.29634 4.55137 12.1192 9.87172 8.20715 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 5.63005 6.29634 6.42493 10.5268 8.73993 11.8946 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 9.42513 9.91321 12.4721 8.60326 9.30299 8.82676 numMergedOcc 0
15 mol 132 unq 0 iso 0 dist 8.7366 5.25894 6.6218 4.90475 7.7059 5.36351 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.50322 6.31523 10.7358 5.37072 7.11802 10.6275 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 5.82404 6.31523 5.58281 10.2385 6.29155 10.6168 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 5.82404 6.31523 5.58281 4.64588 6.80239 8.75049 numMergedOcc 0
19 mol 133 unq 3 iso 0 dist 5.82404 6.31523 5.58281 5.37072 8.00618 10.6275 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 8.07256 9.06801 5.97115 10.4039 8.56324 13.4958 numMergedOcc 0
21 mol 152 unq 1 iso 0 dist 8.07256 9.06801 5.97115 11.1874 6.70283 8.86966 numMergedOcc 0
22 mol 152 unq 2 iso 0 dist 8.07256 9.06801 5.97115 8.36099 7.16148 5.7527 numMergedOcc 0
23 mol 167 unq 0 iso 0 dist 5.59806 6.00793 6.38496 8.66436 9.87651 5.72735 numMergedOcc 0
24 mol 220 unq 0 iso 0 dist 7.16386 8.89394 7.36923 9.02283 9.41367 15.1897 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 9.55777 8.33743 8.6493 6.54251 8.01589 11.9662 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 9.55777 8.33743 8.6493 15.3892 7.7699 15.6298 numMergedOcc 0
27 mol 222 unq 2 iso 0 dist 9.55777 8.33743 8.6493 16.4881 7.21333 14.0597 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.37672 5.68936 5.40456 9.07501 7.57994 10.3622 numMergedOcc 0
29 mol 249 unq 1 iso 0 dist 6.37672 5.68936 5.40456 4.24014 6.18582 7.27415 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 5.90645 4.98888 4.51538 4.62072 8.53687 9.35823 numMergedOcc 0
31 mol 259 unq 1 iso 0 dist 5.90645 4.98888 4.51538 10.4985 8.13497 11.5243 numMergedOcc 0
32 mol 265 unq 0 iso 0 dist 9.772 6.21022 12.0749 5.75478 8.4218 10.6058 numMergedOcc 0
33 mol 273 unq 0 iso 0 dist 8.57501 9.66208 4.89814 6.9795 6.92774 10.2084 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 7.53641 8.25719 9.6563 5.58251 8.2734 13.4294 numMergedOcc 0
