0 mol 24 unq 0 iso 0 dist 9.74777 5.92191 7.49157 11.3578 8.66248 6.86014 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.7649 17.7515 8.23075 14.5512 6.7846 5.54419 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.5268 14.2153 8.23075 10.6956 6.7846 5.54419 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.72036 14.3492 9.02471 20.9981 12.6657 8.80331 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.72036 14.3492 9.02471 20.2843 14.0654 6.20293 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.16745 5.78226 6.23522 10.7814 4.73407 9.38498 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.16745 6.34076 9.10566 6.04163 3.85805 5.93252 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.63792 8.18176 7.61521 9.32453 3.69293 6.97941 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.27814 13.4816 9.01812 12.9998 8.37717 7.95579 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 4.81841 6.56354 7.51733 8.13273 4.73066 9.03572 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 4.81841 6.68919 9.01607 8.13273 4.73066 8.83255 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 5.56598 5.6257 7.53694 8.20009 5.61274 6.44653 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 5.39792 5.0256 7.53694 8.14799 5.61274 6.44653 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 8.44206 5.0256 8.38358 8.14799 3.35803 6.44653 numMergedOcc 0
14 mol 120 unq 3 iso 0 dist 7.00542 8.66137 7.53694 10.7317 5.61274 6.44653 numMergedOcc 0
15 mol 120 unq 4 iso 0 dist 9.78884 8.66137 8.38358 10.7317 3.35803 6.44653 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.01995 4.90674 5.78814 6.29975 6.12885 6.5107 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 8.0697 9.37794 5.36671 19.0933 12.8624 9.87651 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 6.3472 4.51874 4.72821 5.41229 4.69387 6.69288 numMergedOcc 0
19 mol 178 unq 1 iso 0 dist 6.3472 4.51874 4.72821 8.57378 3.70233 6.43573 numMergedOcc 0
20 mol 178 unq 2 iso 0 dist 6.3472 4.51874 4.72821 10.1979 7.39705 7.17202 numMergedOcc 0
21 mol 178 unq 3 iso 0 dist 6.3472 4.51874 4.72821 13.0631 9.77268 8.81551 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 7.24832 10.9813 8.29467 6.43406 6.13927 7.81386 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 7.24832 10.9813 8.29467 13.9818 13.2274 7.63312 numMergedOcc 0
24 mol 253 unq 0 iso 0 dist 8.58013 7.40932 9.19385 9.2166 5.85692 7.32223 numMergedOcc 0
25 mol 253 unq 1 iso 0 dist 8.58013 7.40932 9.19385 11.9908 6.0222 8.31064 numMergedOcc 0
26 mol 253 unq 2 iso 0 dist 8.58013 10.9466 9.1927 11.9908 6.0222 6.73034 numMergedOcc 0
