0 mol 64 unq 0 iso 0 dist 8.0009 8.93949 4.76091 4.39847 7.8986 6.44118 8.91298 5.76037 6.13923 7.24183 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 8.91298 8.93949 6.13923 4.39847 7.24183 6.44118 8.0009 5.76037 4.76091 7.8986 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 9.52282 5.09688 6.89762 11.2351 6.60356 11.5472 17.0053 9.81157 16.105 7.11187 numMergedOcc 0
3 mol 126 unq 0 iso 0 dist 7.80819 9.2806 4.57807 4.30864 7.25133 7.11388 13.0641 13.7598 10.1683 9.33622 numMergedOcc 0
4 mol 189 unq 0 iso 0 dist 9.71306 9.58744 11.7613 6.58275 5.11059 12.8877 9.07003 8.91303 14.7695 7.04604 numMergedOcc 0
5 mol 259 unq 0 iso 0 dist 9.49732 6.49599 11.0067 12.8835 4.55368 13.8509 12.618 6.17736 12.9305 9.45077 numMergedOcc 0
6 mol 259 unq 1 iso 0 dist 9.49732 9.34738 11.569 12.8835 4.55368 14.9816 12.618 6.17736 10.9594 9.45077 numMergedOcc 0
7 mol 259 unq 2 iso 0 dist 9.49732 9.47382 6.18571 12.8835 4.55368 7.93997 12.618 6.17736 8.63445 9.45077 numMergedOcc 0
8 mol 266 unq 0 iso 0 dist 9.64366 9.27588 8.81953 5.89487 6.91743 11.8878 12.0116 6.28482 10.9115 9.63694 numMergedOcc 0
9 mol 287 unq 0 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 9.10473 4.88833 12.6003 7.22938 numMergedOcc 0
10 mol 287 unq 1 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 13.4781 9.86126 15.1886 9.94176 numMergedOcc 0
11 mol 288 unq 0 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 9.10473 4.88833 12.6003 7.22938 numMergedOcc 0
12 mol 288 unq 1 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 13.4781 9.86126 15.1886 9.94176 numMergedOcc 0
13 mol 289 unq 0 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 9.10473 4.88833 12.6003 7.22938 numMergedOcc 0
14 mol 289 unq 1 iso 0 dist 4.66252 9.22576 11.3048 5.44878 4.49185 12.0651 13.4781 9.86126 15.1886 9.94176 numMergedOcc 0
15 mol 293 unq 0 iso 0 dist 8.27274 8.90008 9.35524 11.8152 8.42712 13.1135 10.3468 6.3489 5.66805 8.8788 numMergedOcc 0
