0 mol 48 unq 0 iso 0 dist 7.55854 7.49678 9.90363 5.37112 9.14072 5.06188 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 8.23695 6.57773 13.2028 4.24825 12.0713 7.44913 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 7.04212 6.57773 6.39078 4.24825 10.0764 7.44913 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.07638 7.37476 12.3943 4.49648 8.73093 7.48556 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.07638 7.37476 12.3943 4.50556 9.1622 9.47045 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.07638 7.37476 12.3943 4.53367 12.2532 8.68218 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 6.79787 7.37476 9.57143 4.49648 8.02104 7.48556 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 6.79787 7.37476 9.57143 4.50556 7.59013 9.47045 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 6.79787 7.37476 9.57143 4.53367 10.8016 8.68218 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.0101 7.52544 7.7047 4.77004 7.41861 5.73235 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 9.0101 8.08674 4.00834 4.77004 7.41861 7.48127 numMergedOcc 0
11 mol 90 unq 0 iso 0 dist 8.91055 8.60438 4.59148 9.63545 13.0735 9.06641 numMergedOcc 0
12 mol 91 unq 0 iso 0 dist 8.94991 5.22576 6.16048 6.39764 9.63646 8.91354 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 8.65586 5.90675 5.91317 9.40832 12.9422 8.03869 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 5.99873 8.80616 4.66388 5.64342 8.79677 8.57909 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 9.69111 7.19585 5.21399 5.10257 12.7519 8.72323 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 8.80094 8.66519 16.2482 16.2743 23.3869 8.72323 numMergedOcc 0
17 mol 168 unq 2 iso 0 dist 9.03681 8.66519 5.21399 16.2743 12.7519 8.72323 numMergedOcc 0
18 mol 168 unq 3 iso 0 dist 8.07126 8.35731 16.2482 15.4709 23.3869 8.72323 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.70166 9.12896 5.55359 13.4281 13.5496 9.52029 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 8.17234 5.95601 5.17118 4.47956 9.98251 7.48693 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 8.73545 9.06221 12.4724 4.67806 8.01777 6.9103 numMergedOcc 0
22 mol 233 unq 1 iso 0 dist 8.14581 9.06221 15.2442 4.67806 12.0897 6.9103 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 5.40329 7.73969 6.0905 11.1044 10.752 4.71683 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 7.45786 8.4319 12.8324 10.3585 14.8278 7.58554 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 9.44043 9.27225 9.26732 11.1283 5.9223 8.58092 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.477 9.51286 5.54798 8.13583 12.9059 9.0836 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 9.477 9.51286 5.54798 4.80695 11.907 9.62494 numMergedOcc 0
