0 mol 15 unq 0 iso 0 dist 4.89563 9.60736 6.91314 4.98085 5.89412 6.23015 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.50987 9.41386 12.6859 4.95472 6.85556 13.6622 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.50987 4.71964 5.86705 4.95472 6.85556 6.29797 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.50987 6.58478 10.7201 4.95472 6.85556 9.35837 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.47132 5.14123 6.08003 5.09938 8.08618 9.87767 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 9.13451 8.55869 11.2455 4.14325 5.62052 9.54123 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 9.13451 8.55869 11.2455 5.67656 7.90563 10.5562 numMergedOcc 0
7 mol 135 unq 2 iso 0 dist 9.13451 6.65965 8.50814 4.14325 5.62052 7.28318 numMergedOcc 0
8 mol 135 unq 3 iso 0 dist 9.13451 6.65965 8.50814 5.67656 7.90563 7.17599 numMergedOcc 0
9 mol 135 unq 4 iso 0 dist 9.171 8.55869 5.69612 4.14325 7.85645 9.54123 numMergedOcc 0
10 mol 135 unq 5 iso 0 dist 9.171 8.55869 5.69612 5.67656 8.97655 10.5562 numMergedOcc 0
11 mol 135 unq 6 iso 0 dist 9.171 6.65965 3.95636 4.14325 7.85645 7.28318 numMergedOcc 0
12 mol 135 unq 7 iso 0 dist 9.171 6.65965 3.95636 5.67656 8.97655 7.17599 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 8.68992 5.98495 3.65288 9.13275 7.36698 5.74846 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 6.32172 6.39008 4.88992 5.00423 6.73956 8.62102 numMergedOcc 0
15 mol 182 unq 1 iso 0 dist 6.32172 6.39008 4.88992 5.41536 7.09394 10.0627 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 6.94983 7.13253 5.42461 4.03628 9.05071 6.59036 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.58958 4.37501 5.53885 18.0206 9.81425 14.9726 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.89728 6.93417 11.8896 13.5186 7.08526 14.6679 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 7.29148 9.17392 5.50627 6.48749 7.83341 12.2918 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.87804 8.51266 15.2885 13.9059 7.07965 22.3384 numMergedOcc 0
