0 mol 1 unq 0 iso 0 dist 6.41817 7.16224 6.2936 7.49891 7.83632 10.7639 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.84341 11.3222 6.80314 14.8804 9.877 8.32923 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 7.02884 5.21083 6.80314 12.5119 9.877 8.32923 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.32127 7.39264 8.98417 7.23962 5.497 10.7786 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 5.80623 9.19908 7.96312 10.1283 7.60283 15.4799 numMergedOcc 0
5 mol 27 unq 1 iso 0 dist 5.80623 11.8741 7.67129 10.1283 7.60283 14.1714 numMergedOcc 0
6 mol 27 unq 2 iso 0 dist 7.24775 14.4555 7.96312 3.71754 7.60283 15.4799 numMergedOcc 0
7 mol 27 unq 3 iso 0 dist 7.24775 12.0486 7.67129 3.71754 7.60283 14.1714 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 7.14461 8.37496 8.59105 5.75754 7.2268 5.5768 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 7.14461 8.37496 8.59105 7.55769 8.31175 4.56692 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 6.87901 6.38018 9.6403 7.80268 9.07734 5.54803 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 8.12514 9.28059 7.81731 5.23522 7.70313 5.80806 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 7.85045 9.9965 8.03113 4.98814 7.35992 8.2258 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 7.85045 9.9965 8.03113 9.53721 6.49383 11.1305 numMergedOcc 0
14 mol 116 unq 2 iso 0 dist 7.85045 5.73517 9.2638 4.98814 7.35992 10.3223 numMergedOcc 0
15 mol 116 unq 3 iso 0 dist 7.85045 5.73517 9.2638 9.53721 6.49383 12.8624 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 6.1338 4.07548 6.20426 7.47532 9.33696 9.12244 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 7.06589 9.07394 9.29788 10.6548 9.58354 15.6651 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 7.06589 11.6981 9.50983 10.6548 9.58354 14.0411 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 8.70383 14.7046 9.29788 3.494 9.58354 15.6651 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 8.70383 12.0836 9.50983 3.494 9.58354 14.0411 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 9.00866 8.38548 7.28781 13.4991 8.94909 6.69832 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 9.00866 4.61312 7.00841 13.4991 8.94909 9.65183 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 5.79682 5.10052 8.30195 9.91475 7.48235 7.96744 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 7.37358 8.66108 7.66302 10.1998 9.24367 13.6577 numMergedOcc 0
